4-((3-Chloro-4-fluorophenyl)amino)-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-one

HCID 22390972

기본 정보

표준 SMILES
CN1C(=O)Cc2c(Nc3ccc(F)c(Cl)c3)ncnc21
InChIKey
OVTUVNRVBRGBJR-UHFFFAOYSA-N
분자식
C13H10ClFN4O
평균 분자량
292.69 g/mol

이름 및 식별자

우선 이름
4-((3-Chloro-4-fluorophenyl)amino)-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-one
IUPAC
4-(3-chloro-4-fluoroanilino)-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one

이름 및 동의어

865364-83-64-((3-Chloro-4-fluorophenyl)amino)-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-oneSCHEMBL6214917OVTUVNRVBRGBJR-UHFFFAOYSA-N4-(3-chloro-4-fluoroanilino)-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one4(3-chloro-4-fluoro-phenylamino)-7-methyl-5,7-dihydro-pyrrolo[2,3-d]pyrimidin-6-one4-((3-chloro-4-fluorophenyl)amino)-7-methyl-5,7-dihydro-6H-pyrrolo[2,3-d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-7-methyl-5,7-dihydro-pyrrolo [2,3-d]pyrimidin-6-one4-(3-chloro-4-fluoro-phenylamino)-7-methyl-5,7-dihydro-pyrrolo[2,3-d]pyrimidin-6-one

데이터베이스 식별자

PubChem CID
22390972

물성

구조 계산 물성

XLogP
2.2
극성 표면적
58.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
2
무거운 원자 수
20

관련 반응

20건

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