TL;DR: 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one (CAS 1628353-39-8) is a chemical compound with molecular formula C14H10BrN3O2 and molecular weight 330.99564 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(5-bromo-2-hydroxyphenyl)methylideneamino]-1,3-dihydrobenzimidazol-2-one
Also Known As: 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one, 5-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-dihydrobenzimidazol-2-one, 5-[(E)-[(5-Bromo-2-hydroxyphenyl)methylidene]amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one, 5-[[(5-Bromo-2-hydroxyphenyl)methylidene]amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one, 5-{[(5-bromo-2-hydroxyphenyl)methylidene]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one
| Molecular Formula | C14H10BrN3O2 |
| Molecular Weight | 330.99564 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.99564 Da |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
| SMILES | C1=CC2=C(C=C1N=CC3=C(C=CC(=C3)Br)O)NC(=O)N2 |
| InChIKey | ZVAZYZFTSFSLNW-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one. Following Lipinski's Rule of Five, 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one is 1628353-39-8.
The molecular formula of 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one is C14H10BrN3O2.
The molecular weight of 5-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]-3-hydrobenzimidazol-2-one is 330.99564 g/mol.
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