8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methyl-phenyl)-2-[2-(5-oxo-4,5-dihydro-[1,2,4]-oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
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기본 정보
- 표준 SMILES
Cc1cc(F)ccc1-c1nc(NCCc2noc(=O)[nH]2)nc2c1ccc(=O)n2-c1c(F)cccc1F- InChIKey
KASRXWQPCRJDTI-UHFFFAOYSA-N- 분자식
- C24H17F3N6O3
- 평균 분자량
- 494.4 g/mol
이름 및 식별자
- 우선 이름
- 8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methyl-phenyl)-2-[2-(5-oxo-4,5-dihydro-[1,2,4]-oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
- IUPAC
- 3-[2-[[8-(2,6-difluorophenyl)-4-(4-fluoro-2-methylphenyl)-7-oxopyrido[2,3-d]pyrimidin-2-yl]amino]ethyl]-4H-1,2,4-oxadiazol-5-one
이름 및 동의어
SCHEMBL1065801KASRXWQPCRJDTI-UHFFFAOYSA-N8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methyl-phenyl)-2-[2-(5-oxo-4,5-dihydro-[1,2,4]-oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methyl-phenyl)-2-[2-(5-oxo4,5-dihydro-[1,2,4]-oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methylphenyl)-2-[2-(5-oxo-4,5-dihydro-[1,2,4]-oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one8-(2,6-Difluoro-phenyl)-4-(4-fluoro-2-methylphenyl)-2-[2-(5-oxo-4,5-dihydro-[1,2,4]oxadiazol-3-yl)-ethylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
데이터베이스 식별자
- PubChem CID
- 136076237
물성
구조 계산 물성보충 중
- XLogP
- 3.8
- 극성 표면적
- 109 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 896
관련 반응
5건
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