3-[1-(4-bromophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-6-chloro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[1-(4-bromophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-6-chloro-2H-1-benzopyran-2-one
3-[1-(4-bromophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-6-chloro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K241-0392 |
| Compound Name: | 3-[1-(4-bromophenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-6-chloro-2H-1-benzopyran-2-one |
| Molecular Weight: | 433.71 |
| Molecular Formula: | C18 H10 Br Cl N2 O2 S |
| Smiles: | C1=C(C2=CN(C(N2)=S)c2ccc(cc2)[Br])C(=O)Oc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6477 |
| logD: | 4.6016 |
| logSw: | -5.0177 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.32 |
| InChI Key: | VLOWBRGHNYCZMO-UHFFFAOYSA-N |