기본 정보
- CAS
351341-82-7- 표준 SMILES
O=C(CSc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCN(Cc1ccccc1)C3)c1ccccc1- InChIKey
QYBUFHQALGRGIO-UHFFFAOYSA-N- 분자식
- C30H25N3O2S2
- 평균 분자량
- 523.7 g/mol
- 단동위원소 질량
- 523.1388194
이름 및 식별자
- 우선 이름
- 7-benzyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
- IUPAC
- 11-benzyl-5-phenacylsulfanyl-4-phenyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
- 영어명
- 7-benzyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
- 분자식
- C30H25N3O2S2
- 분자량
- 523.67
이름 및 동의어
351341-82-7ZINC198511997-benzyl-2-phenacylsulfanyl-3-phenyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one7-benzyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-oneOprea1_181582AL-281/11335262MFCD01417774STK055911AKOS00284477311-Benzyl-5-phenacylsulfanyl-4-phenyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-oneZINC000019851199O=C(c1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)Cc1ccccc1
이름 더 보기
Pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 5,6,7,8-tetrahydro-2-[(2-oxo-2-phenylethyl)thio]-3-phenyl-7-(phenylmethyl)-
7benzyl2phenacylsulfanyl3phenyl68dihydro5Hpyrido(23)thieno(24b)pyrimidin4oneC1CN(CC2=C1C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5)CC6=CC=CC=C67-benzyl-2-((2-oxo-2-phenylethyl)thio)-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one7benzyl2((2oxo2phenylethyl)sulfanyl)3phenyl5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one7benzyl2((2oxo2phenylethyl)thio)3phenyl5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
물성
구조 계산 물성
- XLogP
- 6.2
- 극성 표면적
- 107 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 848
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…