기본 정보
- CAS
6081-19-2- 표준 SMILES
CCOC(=O)C1=C(c2ccccc2)N=c2s/c(=C\c3ccc(O)c(OC)c3)c(=O)n2C1c1ccccc1OC- InChIKey
WLKIECJOWOPIDL-ULJHMMPZSA-N- 분자식
- C30H26N2O6S
- 평균 분자량
- 542.6 g/mol
- 단동위원소 질량
- 542.15115773
이름 및 식별자
- 우선 이름
- ethyl (2Z)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-(2-methoxyphenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
- IUPAC
- ethyl (2Z)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-(2-methoxyphenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
이름 및 동의어
6081-19-2ethyl (2Z)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-(2-methoxyphenyl)-3-oxo-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateethyl 2-(4-hydroxy-3-methoxybenzylidene)-5-(2-methoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateAC1NT7RVDTXSID90417466SMSF0013648AKOS001622818AKOS021992439CB07307BIM-0013816.P001SR-01000440612SR-01000440612-1
이름 더 보기
Ethyl (2Z)-2-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-(2-methoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylateETHYL (2Z)-2-[(4-HYDROXY-3-METHOXYPHENYL)METHYLIDENE]-5-(2-METHOXYPHENYL)-3-OXO-7-PHENYL-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
데이터베이스 식별자
- CAS
6081-19-2- PubChem CID
- 5348010
- DTXSID
DTXSID90417466
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 123 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 1,020
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