2-[1-(3-chloro-2-pyridinyl)-3-trifluoromethyl-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazine-4-one

HCID 23150348

기본 정보

표준 SMILES
Cc1cccc2c(=O)oc(-c3cc(C(F)(F)F)nn3-c3ncccc3Cl)nc12
InChIKey
HYXHMJBJRAMKOE-UHFFFAOYSA-N
분자식
C18H10ClF3N4O2
평균 분자량
406.7 g/mol

이름 및 식별자

우선 이름
2-[1-(3-chloro-2-pyridinyl)-3-trifluoromethyl-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazine-4-one
IUPAC
2-[1-(3-chloro-2-pyridinyl)-3-(trifluoromethyl)pyrazol-5-yl]-8-methyl-3,1-benzoxazin-4-one

이름 및 동의어

2-[1-(3-chloro-2-pyridinyl)-3-trifluoromethyl-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazine-4-oneSCHEMBL950940(1-(3-chloro-2-pyridyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazin-4-one2-[1-(3-Chloro-2-pyridinyl)-3-(trifluoromethyl)-1H-pyrazol- 5-yl]-8-methyl-4H-3,1-benzoxazin-4-one2-[1-(3-chloro-2-pyridinyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazin-4-one2-[1-(3-chloro-2-pyridyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-8-methyl-4H-3,1-benzoxazin-4-one

데이터베이스 식별자

PubChem CID
23150348

물성

구조 계산 물성

XLogP
4.4
극성 표면적
69.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
8
회전 가능 결합 수
2
무거운 원자 수
28

관련 반응

13건

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