5-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}-4-phenyl-4H-1,2,4-triazole-3-thiol
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
338397-26-5- 표준 SMILES
FC(F)(F)c1cnc(N2CCC(c3n[nH]c(=S)n3-c3ccccc3)CC2)c(Cl)c1- InChIKey
WOJPHUNUANBFIQ-UHFFFAOYSA-N- 분자식
- C19H17ClF3N5S
- 평균 분자량
- 439.9 g/mol
- 단동위원소 질량
- 439.0845289
이름 및 식별자
- 우선 이름
- 5-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}-4-phenyl-4H-1,2,4-triazole-3-thiol
- IUPAC
- 3-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]-4-phenyl-1H-1,2,4-triazole-5-thione
- 영어명
- 5-(1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-PIPERIDINYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
- 분자식
- C19H17ClF3N5S
- 분자량
- 439.89
이름 및 동의어
338397-26-55-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}-4-phenyl-4H-1,2,4-triazole-3-thiol5-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl}-4-phenyl-4H-1,2,4-triazole-3-thiol3-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]-4-phenyl-1H-1,2,4-triazole-5-thioneAKOS0050848892G-9045-(1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-PIPERIDINYL)-4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL5-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl}-4-phenyl-4H-1,2,4-triazol-3-ylhydrosulfide5-(1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-PIPERIDINYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE3H-1,2,4-Triazole-3-thione, 5-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]-2,4-dihydro-4-phenyl-
데이터베이스 식별자
- CAS
338397-26-5- PubChem CID
- 3840003
물성
구조 계산 물성보충 중
- XLogP
- 4.6
- 극성 표면적
- 75.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 632
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…