6-Fluoro-3-[1-(3-hydroxy-3-ethylpentyl)4-piperidinyl]-1,2-benzisoxazole

HCID 18467342

기본 정보

표준 SMILES
CCC(O)(CC)CCN1CCC(c2noc3cc(F)ccc23)CC1
InChIKey
WPJCCNDFKKOMJI-UHFFFAOYSA-N
분자식
C19H27FN2O2
평균 분자량
334.4 g/mol

이름 및 식별자

우선 이름
6-Fluoro-3-[1-(3-hydroxy-3-ethylpentyl)4-piperidinyl]-1,2-benzisoxazole
IUPAC
3-ethyl-1-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]pentan-3-ol

이름 및 동의어

SCHEMBL1545142WPJCCNDFKKOMJI-UHFFFAOYSA-N6-fluoro-3-[1(3-hydroxy-3-ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole6-Fluoro-3-[1-(3-hydroxy-3-ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole6-fluoro-3-[1-(3-hydroxy-3-ethylpentyl)-4piperidinyl]-1,2-benzisoxazole6-fluoro-3-[1-(3-hydroxy-3-ethylpentyl)4-piperidinyl]-1,2-benzisoxazole6-Fluoro-3-[1-(3-hydroxy-3ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole6-fluoro-3-[l-(3-hydroxy-3-ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole6-Fluoro3-[1-(3-hydroxy-3ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole6-Fluoro-3-[1 -(3-hydroxy-3-ethylpentyl)-4-piperidinyl]-1,2-benzisoxazole

데이터베이스 식별자

PubChem CID
18467342

물성

구조 계산 물성

XLogP
3.8
극성 표면적
49.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
6
무거운 원자 수
24

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