기본 정보
- 표준 SMILES
COc1cc2c(N[C@H](C)c3ccccn3)c(C(N)=O)cnc2cc1-c1c(C)noc1C- InChIKey
XBNCGLIDWYZIGK-GFCCVEGCSA-N- 분자식
- C23H23N5O3
- 평균 분자량
- 417.5 g/mol
이름 및 식별자
- 우선 이름
- 7-(3,5-Dimethylisoxazol-4-yl)-6-methoxy-4-(((R)-1-(pyridin-2-yl)ethyl)amino)quinoline-3-carboxamide
- IUPAC
- 7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinoline-3-carboxamide
이름 및 동의어
1300737-69-27-(3,5-Dimethylisoxazol-4-yl)-6-methoxy-4-(((R)-1-(pyridin-2-yl)ethyl)amino)quinoline-3-carboxamide3-Quinolinecarboxamide, 7-(3,5-dimethyl-4-isoxazolyl)-6-methoxy-4-[[(1R)-1-(2-pyridinyl)ethyl]amino]-SCHEMBL1902577XBNCGLIDWYZIGK-GFCCVEGCSA-NCS-M2160AKOS0376503057-(3,5-dimethyl-4-isoxazolyl)-6-(methoxy)-4-{[(1R)-1-(2-pyridinyl)ethyl]-amino}-3-quinolinecarboxamide7-(3,5-dimethyl-4-isoxazolyl)-6-(methyloxy)-4-{[(1R)-1-(2-pyridinyl)ethyl]amino}-3-quinolinecarboxamideCS-14612C12577
데이터베이스 식별자
- PubChem CID
- 57465585
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 116 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 622
관련 반응
2건
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