3-(1H-benzimidazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
3-(1H-benzimidazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4554-5280 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-6,8-dichloro-2H-1-benzopyran-2-one |
| Molecular Weight: | 331.16 |
| Molecular Formula: | C16 H8 Cl2 N2 O2 |
| Smiles: | C1=C(C(=O)Oc2c1cc(cc2[Cl])[Cl])c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.3664 |
| logD: | 4.3663 |
| logSw: | -4.738 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.864 |
| InChI Key: | QQBULANVRUDXOX-UHFFFAOYSA-N |