4-(3,4,5-Trimethoxybenzoyl)-2-phenylthiazole

HCID 25227430

기본 정보

CAS
1135797-91-9
표준 SMILES
COc1cc(C(=O)c2csc(-c3ccccc3)n2)cc(OC)c1OC
InChIKey
WZEMDWPKLKAUOH-UHFFFAOYSA-N
분자식
C19H17NO4S
평균 분자량
355.4 g/mol

개요

a tubulin modulator and antineoplastic agent; structure in first source

이름 및 식별자

우선 이름
4-(3,4,5-Trimethoxybenzoyl)-2-phenylthiazole
IUPAC
(2-phenyl-1,3-thiazol-4-yl)-(3,4,5-trimethoxyphenyl)methanone

이름 및 동의어

SMART-H1135797-91-9ST20IZ4ME8(2-Phenyl-thiazol-4-yl)-(3,4,5-trimethoxy-phenyl)-methanone(2-Phenyl-4-thiazolyl)(3,4,5-trimethoxyphenyl)methanone4-(3,4,5-trimethoxybenzoyl)-2-phenylthiazoleMethanone, (2-phenyl-4-thiazolyl)(3,4,5-trimethoxyphenyl)-SMART-H cpdRefChem:97099UNII-ST20IZ4ME8(2-phenyl-1,3-thiazol-4-yl)-(3,4,5-trimethoxyphenyl)methanone(2-phenylthiazol-4-yl)-(3,4,5-trimethoxyphenyl)methanone
이름 더 보기
CHEMBL459773WZEMDWPKLKAUOH-UHFFFAOYSA-NSCHEMBL723752GLXC-02417BDBM50587955DB-145742(2-phenyl-4-thiazolyl)-(3,4,5-trimethoxyphenyl)-methanone

데이터베이스 식별자

CAS
1135797-91-9
PubChem CID
25227430
ChEMBL
CHEMBL459773
UNII
ST20IZ4ME8
Nikkaji
J3.712.137A

물성

구조 계산 물성

XLogP
4.2
극성 표면적
85.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
25

관련 반응

25건

화합물 노트

불러오는 중…