Thieno(2,3-d)pyrimidine, 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)-, monohydrochloride
기본 정보
- CAS
99487-26-0- 표준 SMILES
Cc1cc2c(-c3ccccc3F)nc(N3CCNCC3)nc2s1.Cl- InChIKey
ULXKGHLJAPRUPC-UHFFFAOYSA-N- 분자식
- C17H18ClFN4S
- 평균 분자량
- 364.9 g/mol
- 단동위원소 질량
- 364.0924736
이름 및 식별자
- 우선 이름
- Thieno(2,3-d)pyrimidine, 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)-, monohydrochloride
- IUPAC
- 4-(2-fluorophenyl)-6-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidine;hydrochloride
- 영어명
- 5-(2-fluorophenyl)-8-methyl-3-piperazin-1-yl-9-thia-2,4-diazabicyclo[4.3.0]nona-1,3,5,7-tetraene hydrochloride
- 분자식
- C17H18ClFN4S
- 분자량
- 0
이름 및 동의어
99487-26-0Thieno(2,3-d)pyrimidine, 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)-, monohydrochlorideDTXSID502440784-(2-Fluorophenyl)-6-methyl-2-(1-piperazinyl)thieno(2,3-d)pyrimidine monohydrochlorideThieno[2,3-d]pyrimidine, 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)-, monohydrochlorideRefChem:384957DTXCID50166569DDP-225 anhydrousMCI-225 (dehydratase)878C726Z3G4-(2-Fluorophenyl)-6-methyl-2-(piperazin-1-yl)thieno[2,3-d]pyrimidine hydrochlorideSCHEMBL401120
이름 더 보기
MCI-225 dehydrataseMCI-225 hydrochloride5-(2-fluorophenyl)-8-methyl-3-piperazin-1-yl-9-thia-2,4-diazabicyclo[4.3.0]nona-1,3,5,7-tetraene hydrochloride
orb2564648UNII-878C726Z3GHY-123498CS-0082817T880454-(2-Fluorophenyl)-6-methyl-2-(piperazin-1-yl)thieno[2,3-d]pyrimidine--hydrogen chloride (1/1)Thieno[2,3-d]pyrimidine, 4-(2-fluorophenyl)-6-methyl-2-(1-piperazinyl)-, hydrochloride (1:1)
데이터베이스 식별자
- CAS
99487-26-0- PubChem CID
- 3062912
- DTXSID
DTXSID50244078- UNII
- 878C726Z3G
물성
구조 계산 물성
- 극성 표면적
- 69.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 406
관련 반응
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