Methyl 4-(5,7-dichloro-1H-benzo[d]imidazol-2-yl)benzoate

HCID 762579

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Basic information

CAS: 303099-06-1
Standard SMILES: COC(=O)c1ccc(-c2nc3c(Cl)cc(Cl)cc3[nH]2)cc1
InChIKey: YIEMJWNFZGGLOF-UHFFFAOYSA-N
Molecular formula: C15H10Cl2N2O2
Average molar mass: 321.2 g/mol
Monoisotopic mass: 320.011933

Names & identifiers

Preferred name: Methyl 4-(5,7-dichloro-1H-benzo[d]imidazol-2-yl)benzoate
IUPAC: methyl 4-(4,6-dichloro-1H-benzimidazol-2-yl)benzoate

Names & synonyms

303099-06-1Methyl 4-(5,7-dichloro-1H-benzo[d]imidazol-2-yl)benzoatemethyl 4-(4,6-dichloro-1H-benzimidazol-2-yl)benzoateDTXSID401220378AKOS003247635AKOS025136433SR-01000391074SR-01000391074-1Methyl 4-(5,7-dichloro-1H-benzimidazol-2-yl)benzoateMethyl4-(5,7-dichloro-1H-benzo[d]imidazol-2-yl)benzoate

Database identifiers

CAS: 303099-06-1
PubChem CID: 762579
DTXSID: DTXSID401220378

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 55 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 388

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