Methyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole-4-carboxylate

HCID 492679

기본 정보

표준 SMILES
COC(=O)c1cccc2c1nc(-c1c(F)cccc1F)n2Cc1c(F)cccc1F
InChIKey
ARZDBTKIMHITPH-UHFFFAOYSA-N
분자식
C22H14F4N2O2
평균 분자량
414.4 g/mol
단동위원소 질량
414.09914034

이름 및 식별자

우선 이름
Methyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole-4-carboxylate
IUPAC
methyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole-4-carboxylate

이름 및 동의어

CHEMBL388693SCHEMBL5206750BDBM17671ARZDBTKIMHITPH-UHFFFAOYSA-Nmethyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]benzimidazole-4-carboxylatemethyl 1-(2,6-difluorobenzyl)-2-(2,6-difluorophenyl)benzimidazole-4-carboxylate1H-Benzimidazole-4-carboxylic acid, 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-, methyl estermethyl 2-(2,6-difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-1H-1,3-benzodiazole-4-carboxylate

데이터베이스 식별자

PubChem CID
492679
ChEMBL
CHEMBL388693

물성

구조 계산 물성

XLogP
4.9
극성 표면적
44.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
30

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6건

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