3-(4-Phenoxyphenyl)-1-(3R)-3-piperidinyl-N-(triphenylphosphoranylidene)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H35N6OP
Molecular Weight	646.7193
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(4-Phenoxyphenyl)-1-(3R)-3-piperidinyl-N-(triphenylphosphoranylidene)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Structure Search

SMILES

C1CNC[C@@H](C1)N2N=C(C3=C2N=CN=C3N=P(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=C(OC8=CC=CC=C8)C=C7

InChI

InChIKey=CUAUFVPNQHCTHO-WJOKGBTCSA-N

InChI=1S/C40H35N6OP/c1-5-15-32(16-6-1)47-33-25-23-30(24-26-33)38-37-39(42-29-43-40(37)46(44-38)31-14-13-27-41-28-31)45-48(34-17-7-2-8-18-34,35-19-9-3-10-20-35)36-21-11-4-12-22-36/h1-12,15-26,29,31,41H,13-14,27-28H2/t31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H35N6OP
Molecular Weight	646.7193
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 `Wed Apr 02 19:17:50 GMT 2025` Edited by `admin` on `Wed Apr 02 19:17:50 GMT 2025`
Record UNII	UP9UB2QW7S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-(4-phenoxyphenyl)-1-(3R)-3-piperidinyl-N-(triphenylphosphoranylidene)-

Preferred Name

English

3-(4-Phenoxyphenyl)-1-(3R)-3-piperidinyl-N-(triphenylphosphoranylidene)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systematic Name

English

Code System Code Type Description

CAS

2064175-43-3

Created by admin on Wed Apr 02 19:17:50 GMT 2025 , Edited by admin on Wed Apr 02 19:17:50 GMT 2025

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FDA UNII

UP9UB2QW7S

Created by admin on Wed Apr 02 19:17:50 GMT 2025 , Edited by admin on Wed Apr 02 19:17:50 GMT 2025

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