기본 정보
- CAS
421571-95-1- 표준 SMILES
CCOC(=O)C1=C(C)NC2=C(C(=O)CC(c3ccc(OC)c(OC)c3)C2)C1c1cc(OC)c(OC)cc1OC- InChIKey
METZIKDRXPXCDU-UHFFFAOYSA-N- 분자식
- C30H35NO8
- 평균 분자량
- 537.6 g/mol
- 단동위원소 질량
- 537.23626707
이름 및 식별자
- 우선 이름
- Ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
- IUPAC
- ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
- 영어명
- ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
- 분자식
- C30H35NO8
- 분자량
- 537.6008
이름 및 동의어
ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylateethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylateChemDiv1_008914HMS612F04MFCD02224205STK017002AKOS000537858AKOS021998540ethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylateZINC000100575837ZINC000100575840ST50253967
이름 더 보기
AG-690/40749290SR-01000480895SR-01000480895-1CCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CC(C2)c1ccc(c(c1)OC)OCCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3OC)OC)OC)C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)Cethyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,6, 7,8-pentahydroquinoline-3-carboxylateethyl7(34dimethoxyphenyl)2methyl5oxo4(245trimethoxyphenyl)145678hexahydroquinoline3carboxylateethyl7(34dimethoxyphenyl)2methyl5oxo4(245trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
물성
구조 계산 물성
- XLogP
- 4.1
- 극성 표면적
- 102 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 961
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