BMS-599626 Hydrochloride

Basic Information

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CAS Number

873837-23-1

Molecular Formula

C27H28ClFN8O3

Molecular Weight

567.01 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

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

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O=C(Nc1cn2c(c1C)c(ncn2)Nc1ccc2c(c1)cnn2Cc1cccc(c1)F)OC[C@@H]1COCCN1.Cl

InChI

InChI=1S/C27H27FN8O3.ClH/c1-17-23(34-27(37)39-15-22-14-38-8-7-29-22)13-36-25(17)26(30-16-32-36)33-21-5-6-24-19(10-21)11-31-35(24)12-18-3-2-4-20(28)9-18;/h2-6,9-11,13,16,22,29H,7-8,12,14-15H2,1H3,(H,34,37)(H,30,32,33);1H/t22-;/m0./s1

InChIKey

COUSSRGSHIJMMN-FTBISJDPSA-N

LogP

4.277120000000003

Topological Polar Surface Area

119.63000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 11

Complexity

828

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

Carbamic acid,[4-[[1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]-, (3S)-3-morpholinylmethyl ester,monohydrochloride
(S)-morpholin-3-ylmethyl 4-(1- (3-fluorobenzyl)-1H-indazol-5-ylamino) -5-methylpyrrolo[1,2-f][1,2,4] triazin-6-ylcarbama
[(3S)-morpholin-3-yl]methyl N-[4-[[1-[(3-fluorophenyl)methyl]indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]carbamate,hydrochloride
BMS 599626 (AC480)
BMS 599626 HCL
BMS-599626
BMS-599626 (AC480)
Carbamic acid,[4-[[1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,...
Carbamic acid,[4-[[1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]-, (3S)-3-morp
AC480
AC-480
BMS599626
BMS-599626 HCl
BMS-599626 (Hydrochloride)
MLS006011278
AOB1910
ABP000838
SMR004703028
SW219554-1
(S)-morpholin-3-ylmethyl 4-(1- (3-fluorobenzyl)-1H
[4-[[1-[(3-Fluorophenyl)methyl]-1H-indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]carbamic acid (3S)-3-mo
BMS-599626 Hydrochloride
Carbamic acid, [4-[[1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl]amino]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]-, (3S)-3-morpholinylmethyl ester, monohydrochloride (9CI)
(S)-Morpholin-3-ylmethyl (4-((1-(3-fluorobenzyl)-1H-indazol-5-yl)imino)-5-methyl-1,4-dihydropyrrolo[2,1-f][1,2,4]triazin-6-yl)carbamate hydrochloride
BMS 599626 hydrochloride

MDL Number

MFCD12407406

FAQ

What regulatory guidelines apply to BMS-599626 Hydrochloride (CAS: 873837-23-1)?

BMS-599626 Hydrochloride (CAS: 873837-23-1) should comply with international regulations such as REACH in the European Union, which requires registration, evaluation, and authorization of chemical substances. In the USA, it should meet FDA and EPA requirements for chemical substances. Additionally, it must follow GHS classification for hazardous materials handling and labeling.

Are there alternatives to BMS-599626 Hydrochloride (CAS: 873837-23-1) in synthesis?

In synthesis, alternatives to BMS-599626 Hydrochloride (CAS: 873837-23-1) may include similar compounds such as BMS-599626 itself or its structural analogs. Isomers and other reagents might also serve as viable alternatives, depending on the specific application and desired outcome.

What is the market or research trend for BMS-599626 Hydrochloride (CAS: 873837-23-1)?

The market for BMS-599626 Hydrochloride (CAS: 873837-23-1) is primarily driven by its potential applications in research and pharmaceuticals. Recent trends indicate increasing interest in its therapeutic potential, particularly in oncology. Research is likely to focus on optimizing its pharmacological profile and exploring new applications.

How should waste containing BMS-599626 Hydrochloride (CAS: 873837-23-1) be handled?

Waste containing BMS-599626 Hydrochloride (CAS: 873837-23-1) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method, and it’s crucial to follow local and international regulations to ensure safe and environmentally friendly disposal. Protective measures and environmental precautions should be taken to prevent contamination during handling and disposal.