3-(1H-benzimidazol-2-yl)-8-[(diethylamino)methyl]-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-8-[(diethylamino)methyl]-7-hydroxy-2H-1-benzopyran-2-one
3-(1H-benzimidazol-2-yl)-8-[(diethylamino)methyl]-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 3570-0083 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-8-[(diethylamino)methyl]-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C21 H21 N3 O3 |
| Smiles: | CCN(CC)Cc1c(ccc2C=C(C(=O)Oc12)c1nc2ccccc2[nH]1)O |
| Stereo: | ACHIRAL |
| logP: | 3.5287 |
| logD: | 3.0601 |
| logSw: | -3.5289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.845 |
| InChI Key: | PGMWYXYEIOIGHC-UHFFFAOYSA-N |