Exatecan mesylate

Basic Information

View in Editor

CAS Number

169869-90-3

Molecular Formula

C25H26FN3O7S

Molecular Weight

531.56 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

View in Editor

CCC1(C2=C(COC1=O)C(=O)N3CC4=C5C(CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)N)O.CS(=O)(=O)O

InChI

InChI=1S/C24H22FN3O4.CH4O3S/c1-3-24(31)14-6-18-21-12(8-28(18)22(29)13(14)9-32-23(24)30)19-16(26)5-4-11-10(2)15(25)7-17(27-21)20(11)19;1-5(2,3)4/h6-7,16,31H,3-5,8-9,26H2,1-2H3;1H3,(H,2,3,4)/t16-,24-;/m0./s1

InChIKey

BICYDYDJHSBMFS-GRGFAMGGSA-N

LogP

1.9771199999999998

Topological Polar Surface Area

161.80999999999997 Å²

Hydrogen Bond Donor/Acceptor

4 / 10

Complexity

1040

Synonyms & References

English

(1S,9S)-1-Amino-9-ethyl-5-fluoro-9-hydroxy-4-methyl-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinoline-10,13-dione mesylate
Exatecan mesilate
DX-8951f
DX-8951(free base)
(1S,9S)-1-Amino-9-ethyl-5-fluoro-9-hydroxy-4-methyl-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-
Exatecan mesylate
DX8951f
Exatecan Meslate
Exatecan (Mesylate)
Exatecan mesylate anhydrous
Y76278R9RJ
BCP02365
API0010083
5-(2,5-Dimethyl-4-(prop-1-en-1-yl)phenoxy)-2,2-dimethylpentanoic acid
DX 8951f
DX8951f;DX 8951f;DX-8951f
http:////www.amadischem.com/proen/491263/
(1S,9S)-1-amino-9-ethyl-5-fluoro-9-hydroxy-4-methyl-1,2,3,9,12,15-hexahydro-10H,13H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinoline-10,13-dione
methanesulfonate (1:1)
A905704
MFCD04113012
C25H26FN3O7S
WS-01934
10H,13H-Benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione, 1-amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-, (1S-trans)-, monomethanesulfonate (salt)
EXATECAN METHANESULFONATE ANHYDROUS [MI]
DTXSID10168766
10H,13H-Benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione, 1-amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-, (1S,9S)-, methanesulfonate (1:1)
(1S,9S)-1-amino-9-ethyl-5-fluoro-9-hydroxy-4-methyl-2,3,12,15-tetrahydrobenzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinoline-10,13(1H,9H)-dione methanesulfonate
AC-36156
169869-90-3
10H,13H-Benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione, 1-amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-, (1S,9S)-, monomethanesulfonate (salt)

MDL Number

MFCD23102386

FAQ

What regulatory guidelines apply to Exatecan mesylate (CAS: 169869-90-3)?

Exatecan mesylate (CAS: 169869-90-3) falls under the regulatory guidelines of REACH in the European Union, ensuring safe handling and use. It also requires classification and labeling according to GHS (Globally Harmonized System of Classification and Labeling of Chemicals), and may be subject to FDA and EPA regulations in the United States for pharmaceutical and environmental safety.

Are there alternatives to Exatecan mesylate (CAS: 169869-90-3) in synthesis?

There are alternative compounds such as EDOX (Edoxaban mesylate) that can serve as synthetic analogs. Isomers of Exatecan (e.g., E- and Z-isomers) can also be used. Common alternative reagents include other alkylating agents like busulfan or melphalan, which can be used in place of Exatecan mesylate in various reactions.

What is the market or research trend for Exatecan mesylate (CAS: 169869-90-3)?

Exatecan mesylate (CAS: 169869-90-3) is primarily used in cancer chemotherapy. Market trends show growing interest in its therapeutic applications in combination therapies. Research trends focus on optimizing its delivery systems and exploring its efficacy in treating resistant tumors. There is also a trend towards developing more potent analogs and derivatives for improved therapeutic outcomes.

How should waste containing Exatecan mesylate (CAS: 169869-90-3) be handled?

Waste containing Exatecan mesylate (CAS: 169869-90-3) should be collected and stored in appropriate containers with proper labeling. Incineration or professional waste disposal services should be utilized for safe disposal. Environmental protection precautions include ensuring no spillage during handling and adhering to local and international regulations to prevent environmental contamination.