(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol

HCID 11301992

기본 정보

표준 SMILES
CC(C)(C)OC(=O)N1CCC[C@@](O)(C#CCO)[C@@H]1c1ccccc1
InChIKey
BGHZPLJYKUEURG-QFBILLFUSA-N
분자식
C19H25NO4
평균 분자량
331.4 g/mol
단동위원소 질량
331.17835828

이름 및 식별자

우선 이름
(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol
IUPAC
tert-butyl (2S,3R)-3-hydroxy-3-(3-hydroxyprop-1-ynyl)-2-phenylpiperidine-1-carboxylate

이름 및 동의어

SCHEMBL5784123BGHZPLJYKUEURG-QFBILLFUSA-N(2S, 3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn- 1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butoxycarbonyl-3-(3-hydroxypropyn-1-yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-butoxycarbonyl-3-(3-hydroxypropyn-1yl)-2-phenylpiperidin-3-ol(2S,3R)-1-tert-Butyloxycarbonyl-3-(3-hydroxypropyn-1yl)-2-phenylpiperidin-3-ol

데이터베이스 식별자

PubChem CID
11301992
Nikkaji
J1.617.091G

물성

구조 계산 물성

XLogP
1.7
극성 표면적
70 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
24

관련 반응

35건

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