기본 정보
- 표준 SMILES
CCCCc1nc(Cl)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1- InChIKey
AHDSLQVVTUMWQS-UHFFFAOYSA-N- 분자식
- C41H35ClN6O2
- 평균 분자량
- 679.2 g/mol
- 단동위원소 질량
- 678.25100204
이름 및 식별자
- 우선 이름
- 2-Butyl-4-chloro-1-({2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl}methyl)-1H-imidazole-5-carboxylic acid
- IUPAC
- 2-butyl-5-chloro-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid
- 현지명
- N-트리틸로사르탄카르복실산
- 영어명
- N-Trityl Losartan Carboxylic Acid
- 분자식
- C41H35ClN6O2
- 분자량
- 679.21
이름 및 동의어
947331-10-42-Butyl-4-chloro-1-({2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl}methyl)-1H-imidazole-5-carboxylic acid2-butyl-5-chloro-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylic acid2-Butyl-4-chloro-1-((2'-(1-trityl-1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-1H-imidazole-5-carboxylic acidLosartan Impurity 12SCHEMBL498022Allisartan Isoproxil Impurity N2DTXSID80676186AHDSLQVVTUMWQS-UHFFFAOYSA-NDS-0163732-butyl-4-chloro-1- {[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-imidazole-5-carboxylic acid2-Butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Aci;N-Trityl Losartan Carboxylic Acid;2-Butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imida
이름 더 보기
N-트리틸로사르탄카르복실산Azilsartan medoxomil impurity GN-Trityl Losartan Carboxylic AcidAllisartan Isoproxil Intermediates2-butyl-4-chloro-1-((2'-(2-trityl-2H-tetrazol-5-yl)[biphenyl]-4-yl)methyl)-1H-imidazole-5-carboxylic acid2-Butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Aci2-Butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Acid1H-Imidazole-5-carboxylic acid, 2-butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-
2-butyl-4-chloro-1-{[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-imidazole-5-carboxylic acid
데이터베이스 식별자
- CAS
947331-10-4- PubChem CID
- 46783205
- DTXSID
DTXSID80676186
물성
구조 계산 물성
- XLogP
- 9.9
- 극성 표면적
- 98.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 50
- 형식 전하
- 0
- 복잡도
- 1,010
물리화학적 성질
- 끓는 점
- 875.184 · 875.184±75.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.257 · 1.257±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 0.788 · 0.788±0.50(predicted)
화학 및 산업
응용 분야
용도A Losartan derivative for treatment of hypertension
상·하류 제품 정보
상류 원료
공급사8 곳
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