Methyl 6-((4-bromo-2-chlorophenyl)amino)-7-fluoro-1H-benzo[d]imidazole-5-carboxylate

HCID 11749905

기본 정보

CAS
606143-46-8
표준 SMILES
COC(=O)c1cc2[nH]cnc2c(F)c1Nc1ccc(Br)cc1Cl
InChIKey
UQHKKVOOPYVHAL-UHFFFAOYSA-N
분자식
C15H10BrClFN3O2
평균 분자량
398.61 g/mol
단동위원소 질량
396.96289456

이름 및 식별자

우선 이름
Methyl 6-((4-bromo-2-chlorophenyl)amino)-7-fluoro-1H-benzo[d]imidazole-5-carboxylate
IUPAC
methyl 6-(4-bromo-2-chloroanilino)-7-fluoro-3H-benzimidazole-5-carboxylate
영어명
Methyl 6-(4-broMo-2-chlorophenylaMino)-7-fluoro-1H-benzo[d]iMidazole-5-carboxylate
분자식
C15H10BrClFN3O2
분자량
398.61

이름 및 동의어

606143-46-8Methyl 6-((4-bromo-2-chlorophenyl)amino)-7-fluoro-1H-benzo[d]imidazole-5-carboxylatemethyl 6-(4-bromo-2-chloroanilino)-7-fluoro-3H-benzimidazole-5-carboxylateMethyl6-((4-bromo-2-chlorophenyl)amino)-7-fluoro-1H-benzo[d]imidazole-5-carboxylateMethyl 6-(4-broMo-2-chlorophenylaMino)-7-fluoro-1H-benzo[d]iMidazole-5-carboxylatemethyl 6-(4-bromo-2-chlorophenylamino)-7-fluoro-3H-benzo[d]imidazole-5-carboxylateSCHEMBL1037390SCHEMBL8059139SCHEMBL30886595DTXSID30471880UQHKKVOOPYVHAL-UHFFFAOYSA-NDB-334886
이름 더 보기
*Fenthion Impurity 15-13C6methyl 5-(4-bromo-2-chlorophenylamino)-4-fluoro-1H-benzo[d]imidazole-6-carboxylateMethyl 6-((2-chloro-4-bromophenyl)amino)-7-fluoro-1H-benzo[d]imidazol-5-carboxylate1H-Benzimidazole-5-carboxylic acid, 6-[(4-bromo-2-chlorophenyl)amino]-7-fluoro-, methyl ester6-((4-Bromo-2-Chlorophenyl)amino)-7-Fluoro-1H-Benzo[d]Imidazole-5-carboxylic acid methyl ester6-[(4-bromo-2-chlorophenyl)amino]-7-fluoro-1H-Benzimidazole-5-carboxylic acid methyl ester (9CI ACI)1H-Benzimidazole-5-carboxylic acid, 6-[(4-bromo-2-chlorophenyl)amino]-7-fluoro-, methyl ester (9CI, ACI)
6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3H-benzoimidazole-5-carboxylic acid methyl esterMethyl 5-(4-bromo-2-chloroanilino)-4-fluoro-1H-1,3-benzimidazole-6-carboxylate

데이터베이스 식별자

CAS
606143-46-8
PubChem CID
11749905
DTXSID
DTXSID30471880

물성

구조 계산 물성

XLogP
4.9
극성 표면적
67 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
5
회전 가능 결합 수
4
무거운 원자 수
23

물리화학적 성질

끓는 점
539 · 539.0±50.0 °C(Predicted)
밀도
1.722 · 1.722±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
10.14 · 10.14±0.30(Predicted)

화학 및 산업

공급사17 곳

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Nanjing Fred Technology Co., Ltd+86-25-84696168 +86-15380713688 · [email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
南京精瑞久安生物技术有限公司025-58196018 800028039 · [email protected]

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