3-(5-chloro-1H-benzimidazol-2-yl)-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(5-chloro-1H-benzimidazol-2-yl)-6-methoxy-2H-1-benzopyran-2-one
3-(5-chloro-1H-benzimidazol-2-yl)-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1711-1268 |
| Compound Name: | 3-(5-chloro-1H-benzimidazol-2-yl)-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 326.74 |
| Molecular Formula: | C17 H11 Cl N2 O3 |
| Smiles: | COc1ccc2c(C=C(C(=O)O2)c2nc3cc(ccc3[nH]2)[Cl])c1 |
| Stereo: | ACHIRAL |
| logP: | 3.684 |
| logD: | 3.684 |
| logSw: | -4.4245 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.723 |
| InChI Key: | NRQMVILPRNARHS-UHFFFAOYSA-N |