基本情報
- CAS
947331-10-4- 標準SMILES
CCCCc1nc(Cl)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1- InChIKey
AHDSLQVVTUMWQS-UHFFFAOYSA-N- 分子式
- C41H35ClN6O2
- 平均分子量
- 679.2 g/mol
- 単同位体質量
- 678.25100204
名称と識別子
- 優先名称
- 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
- 英語名
- N-Trityl Losartan Carboxylic Acid
- 分子式
- C41H35ClN6O2
- 分子量
- 679.21
名称と別名
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
名称をさらに表示
Azilsartan 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
データベース識別子
- CAS
947331-10-4- PubChem CID
- 46783205
- DTXSID
DTXSID80676186
物性
構造計算による物性
- XLogP
- 9.9
- 極性表面積
- 98.7 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 6
- 回転可能結合数
- 12
- 重原子数
- 50
- 形式電荷
- 0
- 複雑度
- 1,010
物理化学的性質
- 沸点
- 875.184 · 875.184±75.00 °C(Press: 760.00 Torr)(predicted)
- 比重(密度)
- 1.257 · 1.257±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 酸解離定数(Pka)
- 0.788 · 0.788±0.50(predicted)
化学と産業
応用分野
使用A Losartan derivative for treatment of hypertension
上流・下流製品情報
上流原料
サプライヤー8 社
凯试(上海)科技有限公司021-50135380 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
郑州泰丰制药有限公司182-3786-0830 19913859908 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
石家庄耀博医药科技有限公司15633056635 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
関連反応
19 件
化合物ノート
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