기본 정보
- 표준 SMILES
Cl.NC(N)=NCC1CCC(C(=O)Oc2ccccc2C(=O)OCc2ccccc2)CC1- InChIKey
ZNYYFCHDQJQKOK-UHFFFAOYSA-N- 분자식
- C23H28ClN3O4
- 평균 분자량
- 445.9 g/mol
- 단동위원소 질량
- 445.17683406
개요
Benexate hydrochloride is an organic molecular entity.
이름 및 식별자
- 우선 이름
- Benexate hydrochloride
- IUPAC
- benzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate;hydrochloride
- 현지명
- 베넥세이트염산염
- 영어명
- Benexate hydrochloride
- 분자식
- C23H27N3O4.ClH
- 분자량
- 445.94
이름 및 동의어
Benexate hydrochloride78718-25-9QVN4YYK2C686157-90-6Benzyl 2-((4-(guanidinomethyl)cyclohexane-1-carbonyl)oxy)benzoate hydrochlorideBenzyl salicylate trans-4-(guanidinomethyl)cyclohexanecarboxylate hydrochlorideBenzyl 2-((trans-(guanidinomethyl)cyclohexane-1-carbonyl)oxy)benzoate hydrochloridebenzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate;hydrochlorideBenexate HClUNII-QVN4YYK2C6SCHEMBL932658SCHEMBL9099560
이름 더 보기
베넥세이트염산염C13182TKG 01(4β-(Guanidinomethyl)-1α-cyclohexanecarboxylic acid o-(benzyloxycarbonyl)phenyl)·hydrochloride2-[[[4α-(Guanidinomethyl)cyclohexane-1β-yl]carbonyl]oxy]benzoic acid phenylmethyl·hydrochlorideBenzoic acid, 2-[[[trans-4-[[(aminoiminomethyl)amino]methyl]cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, monohydrochlorideBenzoic acid, 2-[[[4-[[(aminoiminomethyl)amino]methyl]cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, monohydrochloride, trans-
CHEBI:31258DTXSID80999968BENEXATE HYDROCHLORIDE [MI](+/-)-BENEXATE HYDROCHLORIDEBENEXATE HYDROCHLORIDE [MART.]BENEXATE HYDROCHLORIDE [WHO-DD]benzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate,hydrochlorideQ27114246
데이터베이스 식별자
- CAS
78718-25-9- PubChem CID
- 444040
- DTXSID
DTXSID80999968- ChEBI
CHEBI:31258- UNII
- QVN4YYK2C6
물성
구조 계산 물성
- 극성 표면적
- 117 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 591
물리화학적 성질
- 녹는점
- 83 ° · 83°
화학 및 산업
응용 분야
개요Benexate hydrochloride is a cytoprotective agent useful in the treatment of ulcers. In experimental models benexate inhibits the decrease of PGE2 and PGI2 induced by indomethacin or stress. Its relatively long duration of action offers a distinct advantage over other cytoprotective drugs.
공급사4 곳
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
南京红胜火生物科技有限公司025-58311670 18020159086 · [email protected]
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