4-[3-[4-(6-Fluoro1,2-benzisoxazol-3-yl)-piperidinyl]-2-hydroxy-1-propoxy]phenyl methyl ether

HCID 18467257

기본 정보

표준 SMILES
COc1ccc(OCC(O)CN2CCC(c3noc4cc(F)ccc34)CC2)cc1
InChIKey
FADILOYYOVHXOZ-UHFFFAOYSA-N
분자식
C22H25FN2O4
평균 분자량
400.4 g/mol

이름 및 식별자

우선 이름
4-[3-[4-(6-Fluoro1,2-benzisoxazol-3-yl)-piperidinyl]-2-hydroxy-1-propoxy]phenyl methyl ether
IUPAC
1-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol

이름 및 동의어

SCHEMBL1545448FADILOYYOVHXOZ-UHFFFAOYSA-N4-[3-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl],2-hydroxy-1-propoxy]phenyl methyl ether4-[3-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-2-hydrox-1-propoxy]phenyl methyl ether4-[3-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-2-hydroxy-1-propoxy]phenyl methyl ether4-[3-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]-2-hydroxy-1propoxy]phenyl methyl ether4-[3-[4-(6-Fluoro1,2-benzisoxazol-3-yl)-1-piperidinyl]-2-hydroxy-1-propoxy]phenyl methyl ether4-[3-[4-(6-Fluoro1,2-benzisoxazol-3-yl)-piperidinyl]-2-hydroxy-1-propoxy]phenyl methyl ether

데이터베이스 식별자

PubChem CID
18467257

물성

구조 계산 물성

XLogP
3.4
극성 표면적
68 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
7
무거운 원자 수
29

관련 반응

49건

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