3-(1H-benzimidazol-2-yl)-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid
3-(1H-benzimidazol-2-yl)-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid
Compound characteristics
| Compound ID: | 8020-5410 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid |
| Molecular Weight: | 306.28 |
| Molecular Formula: | C16 H10 N4 O3 |
| Smiles: | c1ccc2C(N(c3nc4ccccc4[nH]3)N=C(C(O)=O)c2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4464 |
| logD: | -4.2273 |
| logSw: | -2.095 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.674 |
| InChI Key: | BXBIVTVLEKHQAY-UHFFFAOYSA-N |