1,6-Naphthyridine-6(5H)-ethanamine, 2-[[5-fluoro-4-[4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazol-6-yl]-2-pyrimidinyl]amino]-7,8-dihydro-N,N-dimethyl-, maleate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H32F2N8.C4H4O4
Molecular Weight	622.6655
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 1,6-Naphthyridine-6(5H)-ethanamine, 2-[[5-fluoro-4-[4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazol-6-yl]-2-pyrimidinyl]amino]-7,8-dihydro-N,N-dimethyl-, maleate

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CC(C)N1C(C)=NC2=C(F)C=C(C=C12)C3=NC(NC4=NC5=C(CN(CCN(C)C)CC5)C=C4)=NC=C3F

InChI

InChIKey=URQBIQZJYANQEA-BTJKTKAUSA-N

InChI=1S/C27H32F2N8.C4H4O4/c1-16(2)37-17(3)31-26-20(28)12-19(13-23(26)37)25-21(29)14-30-27(34-25)33-24-7-6-18-15-36(11-10-35(4)5)9-8-22(18)32-24;5-3(6)1-2-4(7)8/h6-7,12-14,16H,8-11,15H2,1-5H3,(H,30,32,33,34);1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C27H32F2N8
Molecular Weight	506.5934
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:36:45 GMT 2023` Edited by `admin` on `Sat Dec 16 19:36:45 GMT 2023`
Record UNII	NHT23QWS9P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,6-Naphthyridine-6(5H)-ethanamine, 2-[[5-fluoro-4-[4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazol-6-yl]-2-pyrimidinyl]amino]-7,8-dihydro-N,N-dimethyl-, maleate

Systematic Name

English

6-(2-(dimethylamino)ethyl)-N-(5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazole-6-yl)pyrimidin-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-amine, maleate

Systematic Name

English

Code System Code Type Description

FDA UNII

NHT23QWS9P

Created by admin on Sat Dec 16 19:36:45 GMT 2023 , Edited by admin on Sat Dec 16 19:36:45 GMT 2023

PRIMARY

PUBCHEM

168429510

Created by admin on Sat Dec 16 19:36:45 GMT 2023 , Edited by admin on Sat Dec 16 19:36:45 GMT 2023

PRIMARY

CAS

2834771-17-2

Created by admin on Sat Dec 16 19:36:45 GMT 2023 , Edited by admin on Sat Dec 16 19:36:45 GMT 2023

PRIMARY

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1,6-Naphthyridine-6(5H)-ethanamine, 2-[[5-fluoro-4-[4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazol-6-yl]-2-pyrimidinyl]amino]-7,8-dihydro-N,N-dimethyl-

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