3-{10-[(2-chlorophenyl)methyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid
Chemical Structure Depiction of
3-{10-[(2-chlorophenyl)methyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid
3-{10-[(2-chlorophenyl)methyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid
Compound characteristics
| Compound ID: | 8019-6684 |
| Compound Name: | 3-{10-[(2-chlorophenyl)methyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid |
| Molecular Weight: | 382.8 |
| Molecular Formula: | C19 H15 Cl N4 O3 |
| Smiles: | [H]OC(CCC1C(N2C(=NN=1)N(Cc1ccccc1[Cl])c1ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8293 |
| logD: | 0.17 |
| logSw: | -3.129 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.575 |
| InChI Key: | KQOQTQKBOVZTNN-UHFFFAOYSA-N |