기본 정보
- 표준 SMILES
COc1ccc(CNc2cnc(-c3ccc(OC(F)(F)F)cc3OC)c(OC)n2)cc1- InChIKey
JXWDOAHWBRCHBJ-UHFFFAOYSA-N- 분자식
- C21H20F3N3O4
- 평균 분자량
- 435.4 g/mol
이름 및 식별자
- 우선 이름
- {6-Methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2-yl}[(4-methoxyphenyl)methyl]amine
- IUPAC
- 6-methoxy-N-[(4-methoxyphenyl)methyl]-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2-amine
이름 및 동의어
{6-methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2-yl}[(4-methoxyphenyl)methyl]amineSCHEMBL5417862{6-methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2-yl} [(4-methoxyphenyl)methyl]amine{6-methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2yl} [(4-methoxyphenyl)methyl]amine{6-methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazin-2yl}[(4-methoxyphenyl)methyl]amine{6-methoxy-5-[2-methoxy4-(trifluoromethoxy)phenyl]pyrazin-2-yl }[(4-methoxyphenyl)methyl]amine
데이터베이스 식별자
- PubChem CID
- 22249073
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 74.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 534
관련 반응
6건
화합물 노트
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