Ethyl 2-[(isopropylamino)carbonyl]-3-{[3-(trifluoromethyl)anilino]carbonyl}cyclopropanecarboxylate
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기본 정보
- CAS
318237-97-7- 표준 SMILES
CCOC(=O)C1C(C(=O)Nc2cccc(C(F)(F)F)c2)C1C(=O)NC(C)C- InChIKey
QOIQZYGDBSSSQD-UHFFFAOYSA-N- 분자식
- C18H21F3N2O4
- 평균 분자량
- 386.4 g/mol
- 단동위원소 질량
- 386.14534164
이름 및 식별자
- 우선 이름
- Ethyl 2-[(isopropylamino)carbonyl]-3-{[3-(trifluoromethyl)anilino]carbonyl}cyclopropanecarboxylate
- IUPAC
- ethyl 2-(propan-2-ylcarbamoyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylate
- 영어명
- ETHYL 2-[(ISOPROPYLAMINO)CARBONYL]-3-([3-(TRIFLUOROMETHYL)ANILINO]CARBONYL)CYCLOPROPANECARBOXYLATE
- 분자식
- C18H21F3N2O4
- 분자량
- 386.37
이름 및 동의어
318237-97-7ethyl 2-[(isopropylamino)carbonyl]-3-{[3-(trifluoromethyl)anilino]carbonyl}cyclopropanecarboxylateMLS000696035ethyl 2-(propan-2-ylcarbamoyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylateSMR000334941ethyl 2-[(propan-2-yl)carbamoyl]-3-{[3-(trifluoromethyl)phenyl]carbamoyl}cyclopropane-1-carboxylateBionet1_002796CHEMBL1306993BDBM56702cid_3305661HMS576H18DTXSID601108427
이름 더 보기
ETHYL 2-[(ISOPROPYLAMINO)CARBONYL]-3-([3-(TRIFLUOROMETHYL)ANILINO]CARBONYL)CYCLOPROPANECARBOXYLATECyclopropanecarboxylic acid, 2-[[(1-methylethyl)amino]carbonyl]-3-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]-, ethyl ester
HMS2643H13AKOS0050887973M-9462-(isopropylcarbamoyl)-3-[[3-(trifluoromethyl)phenyl]carbamoyl]cyclopropanecarboxylic acid ethyl ester2-[oxo-(propan-2-ylamino)methyl]-3-[oxo-[3-(trifluoromethyl)anilino]methyl]-1-cyclopropanecarboxylic acid ethyl esterEthyl 2-(isopropylcarbamoyl)-3-((3-(trifluoromethyl)phenyl)carbamoyl)cyclopropane-1-carboxylateEthyl 2-[[(1-methylethyl)amino]carbonyl]-3-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]cyclopropanecarboxylateethyl2-[(propan-2-yl)carbamoyl]-3-{[3-(trifluoromethyl)phenyl]carbamoyl}cyclopropane-1-carboxylate
데이터베이스 식별자
- CAS
318237-97-7- PubChem CID
- 3305661
- DTXSID
DTXSID601108427- ChEMBL
CHEMBL1306993
물성
구조 계산 물성보충 중
- XLogP
- 2
- 극성 표면적
- 84.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 579
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