3-fluoro-4-(3-(8-fluoro-2,4-dioxo-1,2-dihydroquinazolin-3 (4H)-yl)-2-methylphenyl)-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide
기본 정보
- 표준 SMILES
Cc1c(-c2c(F)cc(C(N)=O)c3[nH]c4cc(C(C)(C)O)ccc4c23)cccc1-n1c(=O)[nH]c2c(F)cccc2c1=O- InChIKey
SXAGMGAWHSROAH-UHFFFAOYSA-N- 분자식
- C31H24F2N4O4
- 평균 분자량
- 554.5 g/mol
- 단동위원소 질량
- 554.17656158
이름 및 식별자
- 우선 이름
- 3-fluoro-4-(3-(8-fluoro-2,4-dioxo-1,2-dihydroquinazolin-3 (4H)-yl)-2-methylphenyl)-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide
- IUPAC
- 3-fluoro-4-[3-(8-fluoro-2,4-dioxo-1H-quinazolin-3-yl)-2-methylphenyl]-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide
이름 및 동의어
CHEMBL3907348SCHEMBL16319971SXAGMGAWHSROAH-UHFFFAOYSA-N3-fluoro-4-(3-(8-fluoro-2,4-dioxo-1,2-dihydroquinazolin-3 (4H)-yl)-2-methylphenyl)-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide3-fluoro-4-(3-(8-fluoro-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-2-methylphenyl)-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide
데이터베이스 식별자
- PubChem CID
- 86582487
- ChEMBL
CHEMBL3907348
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 129 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 1,060
관련 반응
1건
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