1-(3-chloro-2-pyridinyl)-N-[2-methyl-6-[[(1-methylethyl)amino]carbonyl]phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

HCID 10298587

기본 정보

표준 SMILES
Cc1cccc(C(=O)NC(C)C)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl
InChIKey
VCJFAZFEDNUPMX-UHFFFAOYSA-N
분자식
C21H19ClF3N5O2
평균 분자량
465.9 g/mol

이름 및 식별자

우선 이름
1-(3-chloro-2-pyridinyl)-N-[2-methyl-6-[[(1-methylethyl)amino]carbonyl]phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
IUPAC
1-(3-chloro-2-pyridinyl)-N-[2-methyl-6-(propan-2-ylcarbamoyl)phenyl]-3-(trifluoromethyl)pyrazole-5-carboxamide

이름 및 동의어

1-(3-chloro-2-pyridinyl)-N-[2-methyl-6-[[(1-methylethyl)amino]carbonyl]phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamideCHEMBL425573SCHEMBL1380391SCHEMBL293934341-(3-Chloro-2-pyridinyl)-N-[2-methyl-6-[[(1-methylethyl)- amino]carbonyl]phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide1-(3-Chloro-2-pyridinyl)-N-[2-methyl-6-[[(1-methylethyl)-amino]carbonyl]phenyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide1-(3-chloro-2-pyridinyl)-n-[2-methyl-6-[[(1-methylethyl)amino]carbonyl]-phenyl]-3-(trifluoromethyl)-1h-pyrazole-5-carboxamide

데이터베이스 식별자

PubChem CID
10298587
ChEMBL
CHEMBL425573
Nikkaji
J2.346.333D

물성

구조 계산 물성

XLogP
4.9
극성 표면적
88.9 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
32

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7건

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