Ethyl 4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]-3-thiophenecarboxylate
기본 정보
- CAS
364612-53-3- 표준 SMILES
CCCOc1ccc(C(=O)Nc2scc(C3COc4ccccc4O3)c2C(=O)OCC)cc1OC- InChIKey
IVQIORBIQHLXTA-UHFFFAOYSA-N- 분자식
- C26H27NO7S
- 평균 분자량
- 497.6 g/mol
- 단동위원소 질량
- 497.15082337
이름 및 식별자
- 우선 이름
- Ethyl 4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]-3-thiophenecarboxylate
- IUPAC
- ethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]thiophene-3-carboxylate
이름 및 동의어
364612-53-3ethyl 4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]-3-thiophenecarboxylateMLS000536941DTXSID601112032MFCD05993837STK054263AKOS005386392ETHYL 4-(2,3-DIHYDRO-1,4-BENZODIOXIN-2-YL)-2-(3-METHOXY-4-PROPOXYBENZAMIDO)THIOPHENE-3-CARBOXYLATEethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]thiophene-3-carboxylateSMR000143578ZINC000002862271ZINC000002862272
이름 더 보기
CCCOc1ccc(cc1OC)C(=O)Nc1scc(c1C(=O)OCC)C1COc2c(O1)cccc2CCCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CS2)C3COC4=CC=CC=C4O3)C(=O)OCC)OCethyl 4-(2,3-dihydro-1,4-benzodioxin-2-yl)-2-{[(3-methoxy-4-propoxyphenyl)carbonyl]amino}thiophene-3-carboxylateETHYL4((2R)23DIHYDRO14BENZODIOXIN2YL)2((3METHOXY4PROPOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATEETHYL4(23DIHYDRO14BENZODIOXIN2YL)2(((3METHOXY4PROPOXYPHENYL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATEETHYL4(23DIHYDRO14BENZODIOXIN2YL)2((3METHOXY4PROPOXYBENZOYL)AMINO)3THIOPHENECARBOXYLATEETHYL4(23DIHYDRO14BENZODIOXIN3YL)2((3METHOXY4PROPOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
데이터베이스 식별자
- CAS
364612-53-3- PubChem CID
- 2960510
- DTXSID
DTXSID601112032
물성
구조 계산 물성
- XLogP
- 5.6
- 극성 표면적
- 121 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 709
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…