3-Cyclopentyl-2-[4-(5-methyl-tetrazol-1-yl)-3-trifluoromethyl-phenyl]-propionic acid

HCID 12019648

기본 정보

표준 SMILES
Cc1nnnn1-c1ccc(C(CC2CCCC2)C(=O)O)cc1C(F)(F)F
InChIKey
LXRXDUIYNAZMOI-UHFFFAOYSA-N
분자식
C17H19F3N4O2
평균 분자량
368.35 g/mol

이름 및 식별자

우선 이름
3-Cyclopentyl-2-[4-(5-methyl-tetrazol-1-yl)-3-trifluoromethyl-phenyl]-propionic acid
IUPAC
3-cyclopentyl-2-[4-(5-methyltetrazol-1-yl)-3-(trifluoromethyl)phenyl]propanoic acid

이름 및 동의어

3-cyclopentyl-2-[4-(5-methyl-tetrazol-1-yl)-3-trifluoromethyl-phenyl]-propionic acidSCHEMBL61753743 -cyclopentyl-2-[4-(5-methyl-tetrazol-1-yl)-3-trifluoromethyl-phenyl]-propionic acid3-cyclopentyl-2-[4-(5 -methyl-tetrazol-1-yl)-3-trifluoromethyl-phenyl]-propionic acid3-cyclopentyl-2-[4-(5-methyl-tetrazol- 1 -yl)-3-trifluoromethyl-phenyl]-propionic acid

데이터베이스 식별자

PubChem CID
12019648

물성

구조 계산 물성

XLogP
4.6
극성 표면적
80.9 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
8
회전 가능 결합 수
5
무거운 원자 수
26

관련 반응

19건

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