기본 정보
- 표준 SMILES
COCOc1ccc(-c2ccc3c(c2CN(C(=O)OCC2c4ccccc4-c4ccccc42)c2ccccc2OC)N(C)C(=O)C(C)(C)N3)c(OC)c1- InChIKey
ZAEUBRGEXFRXSP-UHFFFAOYSA-N- 분자식
- C43H43N3O7
- 평균 분자량
- 713.8 g/mol
이름 및 식별자
- 우선 이름
- 7-(2-Methoxy-4-methoxymethoxyphenyl)-8-[N-(2-methoxyphenyl)-N-(9-fluorenylmethoxycarbonyl)aminomethyl]-1,3,3-trimethyl-3,4-dihydro-1H-quinoxalin-2-one
- IUPAC
- 9H-fluoren-9-ylmethyl N-[[6-[2-methoxy-4-(methoxymethoxy)phenyl]-2,2,4-trimethyl-3-oxo-1H-quinoxalin-5-yl]methyl]-N-(2-methoxyphenyl)carbamate
이름 및 동의어
SCHEMBL1917726ZAEUBRGEXFRXSP-UHFFFAOYSA-N7-(2-Methoxy-4-methoxymethoxyphenyl)-8-[N-(2-methoxyphenyl)-N-(9-fluorenylmethoxycarbonyl)aminomethyl]-1,3,3-trimethyl-3,4-dihydro-1H-quinoxalin-2-one8-[N-(9-Fluorenylmethoxycarbonyl)-N-(2-methoxyphenyl)amino methyl]-7-(2-methoxy-4-methoxymethoxyphenyl)-1,3,3-trimethyl-3,4-dihydro-1H-quinoxalin-2-one8-[N-(9-Fluorenylmethoxycarbonyl)-N-(2-methoxyphenyl)aminomethyl]-7-(2-methoxy-4-methoxymethoxyphenyl)-1,3,3-trimethyl-3,4-dihydro-1H-quinoxalin-2-one
데이터베이스 식별자
- PubChem CID
- 58337196
물성
구조 계산 물성
- XLogP
- 7.5
- 극성 표면적
- 98.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 53
- 형식 전하
- 0
- 복잡도
- 1,210
관련 반응
7건
연결된 노트
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