기본 정보
- 표준 SMILES
Nc1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1- InChIKey
LHEGONYQWRZUFV-UHFFFAOYSA-N- 분자식
- C16H16F3N5O
- 평균 분자량
- 351.33 g/mol
- 단동위원소 질량
- 351.13069464
이름 및 식별자
- 우선 이름
- [4-(6-Aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethylphenyl)methanone
- IUPAC
- [4-(6-aminopyridazin-3-yl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
이름 및 동의어
SCHEMBL937224LHEGONYQWRZUFV-UHFFFAOYSA-N[4-(6-aminopyridazin-3-yl)-piperazin-1-yl]-(2-trifluoromethylphenyl)methanone838828-32-3DB-345056[4-(6-aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethylphenyl)methanone[4-(6-amino pyridazin-3-yl)piperazin-1-yl]-(2-trifluoromethylphenyl)methanone[4-(6-aminopyridazin-3-yl)-piperazin-1-yl]-(2-trifluoromethyl-phenyl)methanone[4-(6-aminopyridazin-3-yl)piperazin-1-yl] (2-trifluoromethylphenyl)methanone[4-(6-aminopyridazin-3-yl)piperazin-1-yl](2-trifiuoromethyl-phenyl)methanone[4-(6-aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethyl-phenyl)methanone[4-(6-aminopyridazin-3-yl)piperazin-1-yl](2-trifluoromethylphenyl)-methanone
이름 더 보기
[4-(6-aminopyridazin-3-yl)piperazin-1-yl]-(2-trifluoromethylphenyl)methanone
데이터베이스 식별자
- PubChem CID
- 66849536
물성
구조 계산 물성
- XLogP
- 1.8
- 극성 표면적
- 75.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 467
관련 반응
210건
화합물 노트
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