Diphenylmethyl alpha-[3-phenoxymethyl-7-oxo-2,6-diaza-4-thiabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(2-chloro-1-hydroxyethylidene)acetate
기본 정보
- 표준 SMILES
O=C(OC(c1ccccc1)c1ccccc1)C(=C(O)CCl)N1C(=O)C2N=C(COc3ccccc3)SC21- InChIKey
HJUUGFWZNVOXLU-UHFFFAOYSA-N- 분자식
- C28H23ClN2O5S
- 평균 분자량
- 535 g/mol
이름 및 식별자
- 우선 이름
- Diphenylmethyl alpha-[3-phenoxymethyl-7-oxo-2,6-diaza-4-thiabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(2-chloro-1-hydroxyethylidene)acetate
- IUPAC
- benzhydryl 4-chloro-3-hydroxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
이름 및 동의어
SCHEMBL11056846HJUUGFWZNVOXLU-UHFFFAOYSA-Ndiphenylmethyl alpha-[3-phenoxymethyl-7-oxo-2,6-diaza-4-thiabicyclo[3,2,0]-hept-2-en-6-yl]-alpha-(2-chloro-1-hydroxyethylidene)acetatediphenylmethyl alpha-[3-phenoxymethyl-7-oxo-2,6-diaza-4-thiabicyclo[3,2,0]-hept-2en-6-yl]-alpha-(2-chloro-1-hydroxyethylidene)acetatediphenylmethyl alpha-[3-phenoxymethyl-7-oxo-2,6-diaza-4-thiabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(2-chloro-1-hydroxyethylidene)acetate
데이터베이스 식별자
- PubChem CID
- 70504488
물성
구조 계산 물성
- XLogP
- 5.7
- 극성 표면적
- 114 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 875
관련 반응
11건
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