(S)-2-(4-Phenoxyphenyl)-7-(piperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide L-dibenzoyltartaric acid salt

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H27N5O2.C18H14O8
Molecular Weight	775.8024
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (S)-2-(4-Phenoxyphenyl)-7-(piperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide L-dibenzoyltartaric acid salt

Structure Search

SMILES

OC(=O)[C@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C2=CC=CC=C2)C(O)=O.NC(=O)C3=C4NCC[C@@H](C5CCNCC5)N4N=C3C6=CC=C(OC7=CC=CC=C7)C=C6

InChI

InChIKey=DRXXIDOAHCGUTR-JPQXQCRWSA-N

InChI=1S/C24H27N5O2.C18H14O8/c25-23(30)21-22(17-6-8-19(9-7-17)31-18-4-2-1-3-5-18)28-29-20(12-15-27-24(21)29)16-10-13-26-14-11-16;19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12/h1-9,16,20,26-27H,10-15H2,(H2,25,30);1-10,13-14H,(H,19,20)(H,21,22)/t20-;13-,14-/m01/s1

HIDE SMILES / InChI

Molecular Formula	C24H27N5O2
Molecular Weight	417.5035
Charge	0
Count

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

Molecular Formula	C18H14O8
Molecular Weight	358.299
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:47:32 GMT 2025` Edited by `admin` on `Wed Apr 02 19:47:32 GMT 2025`
Record UNII	5EQS4B3ZXF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Butanedioic acid, 2,3-bis(benzoyloxy)-, (2R,3R)-, compd. with (7S)-4,5,6,7-tetrahydro-2-(4-phenoxyphenyl)-7-(4-piperidinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (1:1)

Preferred Name

English

(S)-2-(4-Phenoxyphenyl)-7-(piperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide L-dibenzoyltartaric acid salt

Systematic Name

English

Code System Code Type Description

CAS

1633352-72-3

Created by admin on Wed Apr 02 19:47:32 GMT 2025 , Edited by admin on Wed Apr 02 19:47:32 GMT 2025

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FDA UNII

5EQS4B3ZXF

Created by admin on Wed Apr 02 19:47:32 GMT 2025 , Edited by admin on Wed Apr 02 19:47:32 GMT 2025

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