(S)-6-(2-Hydroxy-2-methyl-propyl)-6-phenyl-3-{(S)-1-[4-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-phenyl]-ethyl}-[1,3]oxazinan-2-one

HCID 46865842

기본 정보

표준 SMILES
C[C@@H](c1ccc(-c2nnc(C(F)(F)F)s2)cc1)N1CC[C@](CC(C)(C)O)(c2ccccc2)OC1=O
InChIKey
XJOFVGDCGBUSRW-FYSMJZIKSA-N
분자식
C25H26F3N3O3S
평균 분자량
505.6 g/mol

이름 및 식별자

우선 이름
(S)-6-(2-Hydroxy-2-methyl-propyl)-6-phenyl-3-{(S)-1-[4-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-phenyl]-ethyl}-[1,3]oxazinan-2-one
IUPAC
(6S)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-3-[(1S)-1-[4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]phenyl]ethyl]-1,3-oxazinan-2-one

이름 및 동의어

(S)-6-(2-Hydroxy-2-methyl-propyl)-6-phenyl-3-{(S)-1-[4-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-phenyl]-ethyl}-[1,3]oxazinan-2-oneSCHEMBL2540810

데이터베이스 식별자

PubChem CID
46865842

물성

구조 계산 물성

XLogP
4.8
극성 표면적
104 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
9
회전 가능 결합 수
6
무거운 원자 수
35

관련 반응

1건

화합물 노트

불러오는 중…