트랜스카르복시글리메피리드
trans-Carboxy Glimepiride
기본 정보
- CAS
127554-90-9- 표준 SMILES
CCC1=C(C)CN(C(=O)NCCc2ccc(S(=O)(=O)NC(=O)NC3CCC(C(=O)O)CC3)cc2)C1=O- InChIKey
MMZLACCSCMGVHL-UHFFFAOYSA-N- 분자식
- C24H32N4O7S
- 평균 분자량
- 520.6 g/mol
- 단동위원소 질량
- 520.19917055
이름 및 식별자
- 우선 이름
- trans-Carboxy Glimepiride
- IUPAC
- 4-[[4-[2-[(4-ethyl-3-methyl-5-oxo-2H-pyrrole-1-carbonyl)amino]ethyl]phenyl]sulfonylcarbamoylamino]cyclohexane-1-carboxylic acid
- 현지명
- 트랜스카르복시글리메피리드
- 영어명
- trans-Carboxy Glimepiride
- 분자식
- C24H32N4O7S
- 분자량
- 520.6
이름 및 동의어
trans-Carboxy Glimepiride127554-90-91217739-04-24-(3-((4-(2-(3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamido)ethyl)phenyl)sulfonyl)ureido)cyclohexane-1-carboxylic acid4-[[4-[2-[(4-ethyl-3-methyl-5-oxo-2H-pyrrole-1-carbonyl)amino]ethyl]phenyl]sulfonylcarbamoylamino]cyclohexane-1-carboxylic acid1794752-12-7cis-4-(3-((4-(2-(3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamido)ethyl)phenyl)sulfonyl)ureido)cyclohexane-1-carboxylic acidtrans-4-(3-((4-(2-(3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamido)ethyl)phenyl)sulfonyl)ureido)cyclohexane-1-carboxylic acidtrans-4-[[[[[4-[2-[[(3-Ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]amino]carbonyl]amino]cyclohexanecarboxylic Acid;orb1694442SCHEMBL18157020DTXSID70435183
이름 더 보기
트랜스카르복시글리메피리드Glimepiride trans-Carboxytrans-4-[[[[[4-[2-[[(3-Ethyl-2,5-dihydro-4-Methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]aMino]ethyl]phenyl]sulfonyl]aMino]carbonyl]aMino]cyclohexanecarboxylic Acid
AKOS030254614T356404-[({4-[2-(3-Ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamido)ethyl]benzene-1-sulfonyl}carbamoyl)amino]cyclohexane-1-carboxylic acidCyclohexanecarboxylic acid, 4-[[[[[4-[2-[[(3-ethyl-2,5-dihydro-4-methyl-2-oxo-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulfonyl]amino]carbonyl]amino]-
데이터베이스 식별자
- CAS
127554-90-9- PubChem CID
- 10075365
- DTXSID
DTXSID70435183- Nikkaji
- J564.602B
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 170 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 988
물리화학적 성질
- 녹는점
- 111 · 111-115°C
- 밀도
- 1.396 · 1.396±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 저장 조건
- -20 °C · -20°C Freezer
- 용해도
- DMSO (약간 용해됨), 에틸아세테이트(가열, 초음파 처리), 메탄올(난용성)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 4.52 · 4.520±0.10(predicted)
- 색상
- 흰색에서 옅은 베이지까지
- 안정성
- 흡습성
화학적 성질
White to Off-White Solid
화학 및 산업
응용 분야
용도An active metabolite of Glimepiride (G410150).
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