Xevinapant

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H43N5O4
Molecular Weight	561.7149
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CC[C@H](N1C(=O)[C@H](CN(CC2)C(=O)CC(C)C)NC(=O)[C@H](C)NC)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=LSXUTRRVVSPWDZ-MKKUMYSQSA-N

InChI=1S/C32H43N5O4/c1-21(2)19-28(38)36-18-17-25-15-16-27(37(25)32(41)26(20-36)34-30(39)22(3)33-4)31(40)35-29(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-14,21-22,25-27,29,33H,15-20H2,1-4H3,(H,34,39)(H,35,40)/t22-,25+,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C32H43N5O4
Molecular Weight	561.7149
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:53:45 UTC 2023` Edited by `admin` on `Sat Dec 16 17:53:45 UTC 2023`
Record UNII	N65WC8PXDD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Xevinapant

Official Name

English

xevinapant [INN]

Common Name

English

MSC2735845A

Code

English

DEBIO-1143

Code

English

Xevinapant [WHO-DD]

Common Name

English

XEVINAPANT [USAN]

Common Name

English

SM-406

Code

English

AT-406

Common Name

English

DEBIO 1143

Code

English

(5S,8S,10aR)-N-(diphenylmethyl)-5-[(2S)-2-(methylamino)propanamido]-3-(3-methylbutanoyl)-6-oxodecahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide

Systematic Name

English

IAP INHIBITOR AT-406

Code

English

D-1143

Code

English

Pyrrolo[1,2-a][1,5]diazocine-8-carboxamide, N-(diphenylmethyl)decahydro-5-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-3-(3-methyl-1-oxobutyl)-6-oxo-, (5S,8S,10aR)-

Systematic Name

English

Classification Tree Code System Code

EU-Orphan Drug

EU/3/15/1576