N2-Trityl Olmesartan Acid

HCID 10699800

노트 반응

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기본 정보

표준 SMILES: CCCc1nc(C(C)(C)O)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1
InChIKey: ITUFJDFACFQQAZ-UHFFFAOYSA-N
분자식: C43H40N6O3
평균 분자량: 688.8 g/mol
단동위원소 질량: 688.31618916

이름 및 식별자

우선 이름: N2-Trityl Olmesartan Acid
IUPAC: 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid

이름 및 동의어

752179-89-8N2-Trityl Olmesartan AcidOlmesartan Impurity 714-(2-hydroxypropan-2-yl)-2-propyl-1-((2'-(2-trityl-2H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-1H-imidazole-5-carboxylic acid5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid1H-Imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-[[2'-[2-(triphenylmethyl)-2H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-; 4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[[2'-[2-(triphenylmethyl)-2H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic acid4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[[2'-[2-(triphenylmethyl)-2H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Acid (N2-Tritylolmesartan)SCHEMBL9919774-(2-Hydroxy-2-propanyl)-2-propyl-1-{[2'-(2-trityl-2H-tetrazol-5-yl)-4-biphenylyl]methyl}-1H-imidazole-5-carboxylic acid

데이터베이스 식별자

PubChem CID: 10699800
Nikkaji: J3.450.990E

물성

구조 계산 물성

XLogP: 8.7
극성 표면적: 119 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 7
회전 가능 결합 수: 12
무거운 원자 수: 52
형식 전하: 0
복잡도: 1,080

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