N-[2-(4-Carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl)ethanamine

HCID 14347763

기본 정보

표준 SMILES
COC(=O)COc1ccc(CC(C)NCC(O)c2csc(C(F)(F)F)n2)cc1
InChIKey
RGZIDQJWEHNGQD-UHFFFAOYSA-N
분자식
C18H21F3N2O4S
평균 분자량
418.4 g/mol
단동위원소 질량
418.11741282

이름 및 식별자

우선 이름
N-[2-(4-Carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl)ethanamine
IUPAC
methyl 2-[4-[2-[[2-hydroxy-2-[2-(trifluoromethyl)-1,3-thiazol-4-yl]ethyl]amino]propyl]phenoxy]acetate

이름 및 동의어

N-[2-(4-Carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl)ethanamineSCHEMBL8880221N-[2-(4-Carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl) ethanamineN-[2-(4-carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl)-ethanamineN-[2-(4-Carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethylthiazol-4-yl) ethanamineN-[2-(4-carbomethoxymethoxyphenyl)-1-methylethyl]-2-hydroxy-2-(2-trifluoromethylthiazol-4-yl)ethanamine

데이터베이스 식별자

PubChem CID
14347763

물성

구조 계산 물성

XLogP
2.9
극성 표면적
109 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
10
회전 가능 결합 수
10
무거운 원자 수
28

관련 반응

40건

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