5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine hydrochloride hydrate

HCID 66834029

기본 정보

CAS
1389337-64-7
표준 SMILES
Cl.Nc1cc(C(F)(F)F)c(-c2cc(N3CCOCC3)nc(N3CCOCC3)n2)cn1.O
InChIKey
CWULNKGRTQZGTJ-UHFFFAOYSA-N
분자식
C18H24ClF3N6O3
평균 분자량
464.9 g/mol
단동위원소 질량
464.15505097

이름 및 식별자

우선 이름
5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine hydrochloride hydrate
IUPAC
5-(2,6-dimorpholin-4-ylpyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine;hydrate;hydrochloride

이름 및 동의어

1389337-64-75-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine hydrochloride hydrate5-[2,6-bis(morpholin-4-yl)pyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine hydrate hydrochlorideSCHEMBL896994DTXSID607358615-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-aminehydrochloridehydrate2-Pyridinamine, 5-(2,6-di-4-morpholinyl-4-pyrimidinyl)-4-(trifluoromethyl)-, hydrochloride, hydrate (1:1:1)5-(2,6-Di-4-morpholinyl-4-pyrimidinyl)-4-(trifluoromethyl)pyridin-2-amine monohydrate monohydrochloride5-(2,6-dimorpholin-4-ylpyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine;hydrate;hydrochloride5-[2,6-Bis(morpholin-4-yl)pyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine--hydrogen chloride--water (1/1/1)

데이터베이스 식별자

CAS
1389337-64-7
PubChem CID
66834029
DTXSID
DTXSID60735861

물성

구조 계산 물성

극성 표면적
90.6 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
12
회전 가능 결합 수
3
무거운 원자 수
31

관련 반응

10건

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