기본 정보
- 표준 SMILES
COCN(c1cc(Cl)cnc1C(=O)N1c2ccccc2OCC1C)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1- InChIKey
BNGJHUWZPXLZHO-UHFFFAOYSA-N- 분자식
- C24H20Cl2F3N3O5S
- 평균 분자량
- 590.4 g/mol
이름 및 식별자
- 우선 이름
- 4-chloro-N-[5-chloro-2-(3-methyl-2,3-dihydro-benzo[1,4]oxazine-4-carbonyl)-pyridin-3-yl]-N-methoxymethyl-3-trifluoromethyl-benzenesulfonamide
- IUPAC
- 4-chloro-N-[5-chloro-2-(3-methyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)-3-pyridinyl]-N-(methoxymethyl)-3-(trifluoromethyl)benzenesulfonamide
이름 및 동의어
SCHEMBL3062814-chloro -n[5-chloro-2-(3-methyl-2,3-dihydro-benzo[1,4]oxazine-4-carbonyl)-pyridin-3-yl]-n-methoxymethyl-3-trifluoromethyl-benzenesulfonamide4-chloro-N-[5-chloro-2-(3-methyl-2,3-dihydro-benzo[1,4]oxazine-4-carbonyl)-pyridin-3-yl]-N-methoxymethyl-3-trifluoromethyl-benzenesulfonamide4-Chloro-n[5-chloro-2-(3-methyl-2,3-dihydro-benzo[1,4]oxazine-4-carbonyl)-pyridin-3-yl]-n-methoxymethyl-3-trifluoromethyl-benzenesulfonamide
데이터베이스 식별자
- PubChem CID
- 57942091
물성
구조 계산 물성
- XLogP
- 5.2
- 극성 표면적
- 97.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 940
관련 반응
5건
화합물 노트
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