기본 정보
- CAS
346727-50-2- 표준 SMILES
C=CCn1c(SCc2ccc(Cl)c(Cl)c2)nc2sc3c(c2c1=O)CC(C)(C)OC3- InChIKey
SLIOGDSNJIRMQP-UHFFFAOYSA-N- 분자식
- C21H20Cl2N2O2S2
- 평균 분자량
- 467.4 g/mol
이름 및 식별자
- 우선 이름
- 3-allyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
- IUPAC
- 5-[(3,4-dichlorophenyl)methylsulfanyl]-12,12-dimethyl-4-prop-2-enyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
- 영어명
- 3-allyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
- 분자식
- C21H20Cl2N2O2S2
- 분자량
- 467.43
이름 및 동의어
346727-50-23-allyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one2-[(3,4-dichlorophenyl)methylsulfanyl]-6,6-dimethyl-3-prop-2-enyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-oneOprea1_119426STK831092AKOS0016374245-[(3,4-Dichlorophenyl)methylsulfanyl]-12,12-dimethyl-4-prop-2-enyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-oneAK-968/12862095SR-01000465226SR-01000465226-12-[(3,4-dichlorobenzyl)sulfanyl]-6,6-dimethyl-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one3-allyl-2-((3,4-dichlorobenzyl)thio)-6,6-dimethyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one
이름 더 보기
4H-Pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[(3,4-dichlorophenyl)methyl]thio]-3,5,6,8-tetrahydro-6,6-dimethyl-3-(2-propen-1-yl)-
데이터베이스 식별자
- CAS
346727-50-2
물성
구조 계산 물성
- XLogP
- 5.6
- 극성 표면적
- 95.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 690
화학 및 산업
공급사2 곳
Interbioscreen Ltd.[email protected]
SPECS[email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…