(4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide | CAS No. 1207283-85-9

(4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide

Basic Information

CAS Number

1207283-85-9

Molecular Formula

C27H31FN4O8

Molecular Weight

558.56 g/mol

AD

Basic Physical Properties

Solubility

Insuluble (1.1E-3 g/L) (25 ºC),

CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(c(c4C(=O)C3=C([C@@]2(C(=O)C(=C1O)C(=O)N)O)O)O)NC(=O)CN5CCCC5)F

InChI

InChI=1S/C27H31FN4O8/c1-31(2)20-13-8-11-7-12-14(28)9-15(30-16(33)10-32-5-3-4-6-32)21(34)18(12)22(35)17(11)24(37)27(13,40)25(38)19(23(20)36)26(29)39/h9,11,13,20,34,36-37,40H,3-8,10H2,1-2H3,(H2,29,39)(H,30,33)/t11-,13-,20-,27-/m0/s1

InChIKey

HLFSMUUOKPBTSM-ISIOAQNYSA-N

LogP

0.29400000000000115

Topological Polar Surface Area

193.73 Ų

Hydrogen Bond Donor/Acceptor

7 / 12

Complexity

1200

Synonyms & References

English

  • TP-434
  • (4S,4aS,5aR,12aR)-4-(dimethylamino)-7-fluoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-9-[(2-pyrrolidin-1-ylacetyl)amino]-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
  • (4S,4Ar,5aS,12aR)-4-(dimethylamino)-7-fluoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-9-[(2-pyrrolidin-1-

MDL Number

MFCD31010183

FAQ

What is (4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide (CAS: 1207283-85-9)?

This compound is a complex organic molecule with multiple functional groups, including amino, carboxamide, and ether functionalities. It is characterized by its tetranuclear core and various substituents. The molecule exhibits a combination of hydrophilic and lipophilic properties due to its structure.

What are the main uses of (4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide (CAS: 1207283-85-9)?

This compound is primarily used in pharmaceutical research and development, particularly in the synthesis of novel drug candidates. It may also find applications in organic chemistry as a building block for synthesizing other complex molecules.

Is (4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide (CAS: 1207283-85-9) safe?

This compound is generally considered safe for laboratory use under proper handling and storage conditions. However, it is advisable to follow all safety protocols, including the use of appropriate personal protective equipment (PPE) and proper ventilation. Immediate medical attention should be sought if exposure occurs.

How should (4S,4aS,5aR,12aS)-4-(Dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-[(1-pyrrolidinylacetyl)amino]-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide (CAS: 1207283-85-9) be stored?

This compound should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep it in a tightly sealed container to prevent degradation. High humidity should be avoided to maintain the integrity of the molecule. Proper labeling and documentation are essential for safe storage and handling.

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