4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide
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기본 정보
- CAS
139756-03-9- 표준 SMILES
CCCc1nn(C)c(C(N)=O)c1NC(=O)c1ccccc1OCC- InChIKey
UAFIHVRUICMADE-UHFFFAOYSA-N- 분자식
- C17H22N4O3
- 평균 분자량
- 330.4 g/mol
- 단동위원소 질량
- 330.16919056
이름 및 식별자
- 우선 이름
- 4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide
- IUPAC
- 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propylpyrazole-5-carboxamide
- 영어명
- 4-(2-Ethoxy benzamido)-1-methyl-3-n-propyl pyrazole-5-carboxamide.
- 분자식
- C17H22N4O3
- 분자량
- 330.38
이름 및 동의어
139756-03-9Sildenafil di-amide impuritySildenafil carboxamide impurity8M7KI0WTIA4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide1H-Pyrazole-5-carboxamide, 4-((2-ethoxybenzoyl)amino)-1-methyl-3-propyl-4-((2-Ethoxybenzoyl)amino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-1H-pyrazole-5-carboxamide1H-Pyrazole-5-carboxamide, 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-RefChem:10698214-(2-ethoxybenzamido)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-(2-Ethoxybenzamido)-1-methyl-3-n-propylpyrazole-5-carboxamide
이름 더 보기
4-[(2-Ethoxybenzoyl)aMino]-1-Methyl-3-propyl-4-(2-Ethoxybenzaini do) -1 -methyl-3-n-pro pylpyrazole-5-carboxaniide7-chloro-5-(2-ethoxyphenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidine
UNII-8M7KI0WTIA4-[(2-ethoxybenzoyl)amino]-2-methyl-5-propylpyrazole-3-carboxamide4-(2-Ethoxybenzoylamino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-(2-ETHOXY BENZAMIDO)-1-METHYL-3-N-PROPYL PYRAZOLE-5-CARBOXAMIDE.Sildenafil Impurity 111H-Pyrazole-5-carboxamide, 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-; 4-[(2-Ethoxybenzoyl)amino]-1-methyl-3-propyl-1H-pyrazole-5-carboxamide; 4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide; 4-(2-Ethoxybenzoylamino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamideSCHEMBL1792Oprea1_191426
데이터베이스 식별자
- CAS
139756-03-9- PubChem CID
- 850135
- DTXSID
DTXSID40357308- UNII
- 8M7KI0WTIA
- Nikkaji
- J1.557.987K
물성
구조 계산 물성보충 중
- XLogP
- 2.4
- 극성 표면적
- 99.2 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 446
물리화학적 성질
- 녹는점
- 153 · 153-155 °C
- 끓는 점
- 445.5 · 445.5±45.0 °C(Predicted)
- 밀도
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- 저장 조건
- Refrigerator
- 용해도
- DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 12.65 · 12.65±0.70(Predicted)
- 색상
- 흰색에서 황백색까지
화학 및 산업
응용 분야
용도An impurity of Sildenafil (S435000) (impurity C).
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하류 제품
관련 반응
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