tert-butyl(2-(7-(4-(3-(2,4-difluorophenyl)ureido)-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)-1-methyl-1H-imidazol-5-yl)methyl(2-methoxyethyl)carbamate

HCID 67049419

기본 정보

표준 SMILES
COCCN(Cc1cnc(-c2cc3nccc(Oc4ccc(NC(=O)Nc5ccc(F)cc5F)cc4F)c3s2)n1C)C(=O)OC(C)(C)C
InChIKey
UIZFZXDARHOPGC-UHFFFAOYSA-N
분자식
C33H33F3N6O5S
평균 분자량
682.7 g/mol

이름 및 식별자

우선 이름
tert-butyl(2-(7-(4-(3-(2,4-difluorophenyl)ureido)-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)-1-methyl-1H-imidazol-5-yl)methyl(2-methoxyethyl)carbamate
IUPAC
tert-butyl N-[[2-[7-[4-[(2,4-difluorophenyl)carbamoylamino]-2-fluorophenoxy]thieno[3,2-b]pyridin-2-yl]-3-methylimidazol-4-yl]methyl]-N-(2-methoxyethyl)carbamate

이름 및 동의어

SCHEMBL1481553UIZFZXDARHOPGC-UHFFFAOYSA-Ntert-butyl (2-(7-(4-(3-(2,4-difluorophenyl)ureido)-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)-1-methyl-1H-imidazol-5-yl)methyl(2-methoxyethyl)carbamatetert-butyl(2-(7-(4-(3-(2,4-difluorophenyl)ureido)-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)-1-methyl-1H-imidazol-5-yl)methyl(2-methoxyethyl)carbamate

데이터베이스 식별자

PubChem CID
67049419

물성

구조 계산 물성

XLogP
4.7
극성 표면적
148 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
11
회전 가능 결합 수
12
무거운 원자 수
48

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4건

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