2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]thio]phenoxy]acetic acid ethyl ester

HCID 11525877
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCOC(=O)COc1ccc(SCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C
InChIKey
UFVBRBHUNZQEET-UHFFFAOYSA-N
분자식
C23H22F3NO3S2
평균 분자량
481.6 g/mol
단동위원소 질량
481.0993204

이름 및 식별자

우선 이름
2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]thio]phenoxy]acetic acid ethyl ester
IUPAC
ethyl 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetate

이름 및 동의어

2-[2-methyl-4-[[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methyl]thio]phenoxy]acetic acid ethyl esterethyl 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetate343322-83-8SCHEMBL13647570ethyl {2-methyl-4-[({4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole-5-yl}methyl)sulfanyl]phenoxy}acetate

데이터베이스 식별자

PubChem CID
11525877
Nikkaji
J2.218.468G

물성

구조 계산 물성

XLogP
6.6
극성 표면적
102 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
9
회전 가능 결합 수
9
무거운 원자 수
32

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