N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl- 1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide | CAS No. 1949837-12-0

N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl- 1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide

Basic Information

CAS Number

1949837-12-0

Molecular Formula

C49H60ClN9O7S2

Molecular Weight

986.66 g/mol

AD

Basic Physical Properties

Cc1c(sc-2c1C(=N[C@H](c3n2c(nn3)C)CC(=O)NCCOCCCOCC(=O)N[C@H](C(=O)N4C[C@@H](C[C@H]4C(=O)N[C@@H](C)c5ccc(cc5)c6c(ncs6)C)O)C(C)(C)C)c7ccc(cc7)Cl)C

InChI

InChI=1S/C49H60ClN9O7S2/c1-27-30(4)68-48-41(27)42(33-14-16-35(50)17-15-33)54-37(45-57-56-31(5)59(45)48)23-39(61)51-18-21-65-19-9-20-66-25-40(62)55-44(49(6,7)8)47(64)58-24-36(60)22-38(58)46(63)53-28(2)32-10-12-34(13-11-32)43-29(3)52-26-67-43/h10-17,26,28,36-38,44,60H,9,18-25H2,1-8H3,(H,51,61)(H,53,63)(H,55,62)/t28-,36+,37-,38-,44+/m0/s1

InChIKey

PQOGZKGXGLHDGS-QQRWPDCKSA-N

LogP

6.53118000000001

Topological Polar Surface Area

202.26000000000002 Ų

Hydrogen Bond Donor/Acceptor

4 / 16

Complexity

1750

Synonyms & References

English

  • ARV-771
  • ARV 771
  • ARV771
  • GTPL10564
  • s8532
  • (2S,4R)-1-[(2S)-2-[[2-[3-[2-[[2-[(9S)-7-(4-Chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatr

MDL Number

MFCD30738017

FAQ

What is N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide (CAS: 1949837-12-0)?

This compound is a complex heterocyclic organic molecule with a unique structure. It contains multiple functional groups and ring systems, including thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, phenyl, and thiazole. It is used primarily in the pharmaceutical industry for drug development.

What are the main uses of N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide (CAS: 1949837-12-0)?

This compound is primarily used in the pharmaceutical industry for research and development of potential therapeutic agents. It may also have applications in the treatment of specific diseases or conditions.

Is N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide (CAS: 1949837-12-0) safe?

This compound is considered safe when handled properly. However, it should be used with caution as it may cause skin irritation or other adverse effects. Protective gloves and goggles should be worn, and it should be stored away from sources of heat and light.

How should N-({3-[2-({[(6S)-4-(4-Chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)ethoxy]propoxy}acetyl)-3-methyl-L-valyl-(4R)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide (CAS: 1949837-12-0) be stored?

This compound should be stored in a cool, dry place, away from sources of heat and light. It should be kept in a tightly sealed container to protect it from moisture and impurities. Additionally, it should be stored in a well-ventilated area to prevent the accumulation of flammable gases or vapors.

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