Primary record
Dasminapant
- CAS
- 1570231-89-8
- PubChem CID
- 73336238
- SMILES
- C[C@@H](C(=O)N[C@H]1CN(CC[C@H]2CC[C@H](N2C1=O)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C5=CC(=CC=C5)S(=O)(=O)N6CC[C@H]7CC[C@H](N7C(=O)[C@H](C6)NC(=O)[C@H](C)NC)C(=O)NC(C8=CC=CC=C8)C9=CC=CC=C9)NC
- Molecular Formula
- C60H72N10O10S2
- Molecular Weight
- 1157.43
- Exact Mass
- 1156.4874
- InChI
- InChI=1S/C60H72N10O10S2/c1-39(61-3)55(71)63-49-37-67(34-32-45-28-30-51(69(45)59(49)75)57(73)65-53(41-18-9-5-10-19-41)42-20-11-6-12-21-42)81(77,78)47-26-17-27-48(36-47)82(79,80)68-35-33-46-29-31-52(70(46)60(76)50(38-68)64-56(72)40(2)62-4)58(74)66-54(43-22-13-7-14-23-43)44-24-15-8-16-25-44/h5-27,36,39-40,45-46,49-54,61-62H,28-35,37-38H2,1-4H3,(H,63,71)(H,64,72)(H,65,73)(H,66,74)/t39-,40-,45+,46+,49-,50-,51-,52-/m0/s1
- InChIKey
- AKLBERUGKZNEJY-RTEPGWBGSA-N
- LogP
- 3.1916
- TPSA
- 255.84
Names and synonyms
- Dasminapant
- APG-1387
- dasminapant [INN]
- Dasminapant [WHO-DD]
- 1570231-89-8
- RefChem:113310
- E53VN70K2X
- UNII-E53VN70K2X
- Apg 1387
- APG1387
- SMAC-mimetic APG-1387
- IAP Inhibitor APG-1387
- IAP Antagonist APG-1387
- orb1698373
- CHEMBL5440380
- SCHEMBL15490706
- APG-1387 (SMAC MIMETIC)
- EX-A5180
- SM-1387
- APG-1387?
- NSC834197
- AKOS040750540
- NSC-834197
- MS-32020
- HY-125593
- CS-0092417
- G17587
- A942819
- Pyrrolo(1,2-a)(1,5)diazocine-8-carboxamide, 3,3'-(1,3-phenylenebis(sulfonyl))bis(N-(diphenylmethyl)decahydro-5-(((2S)-2-(methylamino)-1-oxopropyl)amino)-6-oxo-, (5S,5'S,8S,8'S,10aR,10'ar)-
- (S,5S,5'S,8S,8'S,10aR,10a'R)-3,3'-(1,3-Phenylenedisulfonyl)bis(N-benzhydryl-5-((S)-2-(methylamino)propanamido)-6-oxodecahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide)