기본 정보
- CAS
1798390-48-3- 표준 SMILES
Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](NC(=O)C(C)(C)C)[C@H]3SC2)s1- InChIKey
PYQNLAKCAGCVKA-BXKDBHETSA-N- 분자식
- C16H20N4O4S3
- 평균 분자량
- 428.6 g/mol
이름 및 식별자
- 우선 이름
- Cefazolin EP Impurity B
- IUPAC
- (6R,7R)-7-(2,2-dimethylpropanoylamino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- 영어명
- (6R,7R)-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- 분자식
- C16H20N4O4S3
- 분자량
- 428.55
이름 및 동의어
Cefazolin pivaloyl2384108-14-7Cefazolin EP Impurity B7-Pivalamido Cefazolin1798390-48-3(6R,7R)-7-(2,2-dimethylpropanoylamino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid705J53S4IH(6R,7R)-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid(6R,7R)-7-[(2,2-dimethylpropanoyl)amino]-3-[[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid(6R,7R)-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid(6R,7R)-3-((5-Methyl-1,3,4-thiadiazol-2-ylthio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((2,2-dimethyl-1-oxopropyl)amino)-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-, (6R,7R)-
이름 더 보기
rac-(6R,7R)-3-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acidrel-(6R,7R)-3-(((5-Methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-8-oxo-7-pivalamido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (Cefazolin Impurity)5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[(2,2-dimethyl-1-oxopropyl)amino]-3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-, (6R,7R)-rel-
데이터베이스 식별자
- CAS
1798390-48-3- UNII
- 705J53S4IH
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 191 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 694
물리화학적 성질
- 밀도
- 1.52 · 1.52±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 2.62 · 2.62±0.50(Predicted)
화학 및 산업
공급사14 곳
济南百隆化学有限公司[email protected] · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
希瓦生物科技（广州）有限公司13268215580 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
苏州键合化学试剂有限公司0512-69561983 13914027025 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
成都塞欧斯医药科技有限公司028-64971018 18108168130
苏州美诺医药科技有限公司0512-69561983 13914027025 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
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