3-[1-(2-chlorophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[1-(2-chlorophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
3-[1-(2-chlorophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K241-0373 |
| Compound Name: | 3-[1-(2-chlorophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 384.84 |
| Molecular Formula: | C19 H13 Cl N2 O3 S |
| Smiles: | COc1cccc2C=C(C3=CN(C(N3)=S)c3ccccc3[Cl])C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.6096 |
| logD: | 2.67 |
| logSw: | -4.1028 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.334 |
| InChI Key: | XWQUTJRCXGFMFP-UHFFFAOYSA-N |