BI-2536

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H39N7O3
Molecular Weight	521.6544
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H]1N(C2CCCC2)C3=NC(NC4=CC=C(C=C4OC)C(=O)NC5CCN(C)CC5)=NC=C3N(C)C1=O

InChI

InChIKey=XQVVPGYIWAGRNI-JOCHJYFZSA-N

InChI=1S/C28H39N7O3/c1-5-22-27(37)34(3)23-17-29-28(32-25(23)35(22)20-8-6-7-9-20)31-21-11-10-18(16-24(21)38-4)26(36)30-19-12-14-33(2)15-13-19/h10-11,16-17,19-20,22H,5-9,12-15H2,1-4H3,(H,30,36)(H,29,31,32)/t22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H39N7O3
Molecular Weight	521.6544
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:11:44 UTC 2023` Edited by `admin` on `Fri Dec 15 15:11:44 UTC 2023`
Record UNII	4LJG22T9C6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BI-2536

Code

English

(R)-4-((8-CYCLOPENTYL-7-ETHYL-5,6,7,8-TETRAHYDRO-5-METHYL-6-OXO-2-PTERIDINYL)AMINO)-3-METHOXY-N-(1-METHYL-4-PIPERIDINYL)BENZAMIDE

Systematic Name

English

BENZAMIDE, 4-(((7R)-8-CYCLOPENTYL-7-ETHYL-5,6,7,8-TETRAHYDRO-5-METHYL-6-OXO-2-PTERIDINYL)AMINO)-3-METHOXY-N-(1-METHYL-4-PIPERIDINYL)-

Systematic Name

English

BI2536

Code

English

BI 2536 [WHO-DD]

Common Name

English

Code System Code Type Description

ChEMBL

CHEMBL513909