기본 정보
- CAS
1705612-82-3- 표준 SMILES
CO/N=C(/C(=O)N[C@@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(C)CS[C@H]12)c1csc(N)n1- InChIKey
DASYMCLQENWCJG-VCUHZILTSA-N- 분자식
- C20H25N5O7S2
- 평균 분자량
- 511.6 g/mol
- 단동위원소 질량
- 511.1195405
이름 및 식별자
- 우선 이름
- (E)-Cefetamet Pivoxil
- IUPAC
- 2,2-dimethylpropanoyloxymethyl (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- 영어명
- (E)-Cefetamet Pivoxil
- 분자식
- C20H25N5O7S2
- 분자량
- 511.57
이름 및 동의어
(E)-Cefetamet Pivoxil1705612-82-32,2-dimethylpropanoyloxymethyl (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate(E)-CefetametPivoxilCefetamet Pivoxil, (E)-SCHEMBL2369390CHEMBL23656879H59EBV693AKOS015896628(2,2-Dimethyl-1-oxopropoxy)methyl (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-(methoxyimino)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate(6R,7R)-(pivaloyloxy)methyl 7-((E)-2-(2-imino-2,3-dihydrothiazol-4-yl)-2-(methoxyimino)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate(E)-Cefetamet Pivoxil; 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-(methoxyimino)acetyl]amino]-3-methyl-8-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, (6R,7R)-; (2,2-Dimethyl-1-oxopropoxy)methyl (6R,7R)-7-[[(2E)-2-(2-amino-4-thiaz
이름 더 보기
Cefetamet Impurity（7E)-Cefetamet Pivoxil(6R,7R)-7-[[(2E)-2-(2-AMino-4-thiazolyl)-2-(MethoxyiMino)acetyl]aMino]-3-Methyl -8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 216 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 12
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 933
물리화학적 성질
- 밀도
- 1.55 · 1.55±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.21 · 8.21±0.60(Predicted)
화학 및 산업
응용 분야
용도The E-isomer of Cefetamet Pivoxil (C242780).
공급사10 곳
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