tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate, (R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H30N6O3
Molecular Weight	486.5655
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate, (R)-

Structure Search

SMILES

CC(C)(C)OC(=O)N1CCC[C@H](C1)N2N=C(C3=C2N=CN=C3N)C4=CC=C(OC5=CC=CC=C5)C=C4

InChI

InChIKey=NTSAEGNFPKKRLX-LJQANCHMSA-N

InChI=1S/C27H30N6O3/c1-27(2,3)36-26(34)32-15-7-8-19(16-32)33-25-22(24(28)29-17-30-25)23(31-33)18-11-13-21(14-12-18)35-20-9-5-4-6-10-20/h4-6,9-14,17,19H,7-8,15-16H2,1-3H3,(H2,28,29,30)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H30N6O3
Molecular Weight	486.5655
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 17:48:04 GMT 2025` Edited by `admin` on `Wed Apr 02 17:48:04 GMT 2025`
Record UNII	J3879KEU46
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate, (R)-

Systematic Name

English

(R)-3-[4-Amino-3-(4-phenoxy-phenyl)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid tert-butyl ester

Preferred Name

English

1,1-Dimethylethyl (3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinecarboxylate

Systematic Name

English

1-Piperidinecarboxylic acid, 3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-, 1,1-dimethylethyl ester, (3R)-

Systematic Name

English

(R)-tert-Butyl 3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate

Systematic Name

English

Code System Code Type Description

PUBCHEM

59799012

Created by admin on Wed Apr 02 17:48:04 GMT 2025 , Edited by admin on Wed Apr 02 17:48:04 GMT 2025

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FDA UNII

J3879KEU46

Created by admin on Wed Apr 02 17:48:04 GMT 2025 , Edited by admin on Wed Apr 02 17:48:04 GMT 2025

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CAS

1022150-11-3

Created by admin on Wed Apr 02 17:48:04 GMT 2025 , Edited by admin on Wed Apr 02 17:48:04 GMT 2025

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