1-[4-(benzylamino)-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(benzylamino)-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
1-[4-(benzylamino)-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 6623-0942 |
| Compound Name: | 1-[4-(benzylamino)-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C20 H19 N3 O S |
| Smiles: | CC1=C(C(NCc2ccccc2)=NC(N1c1ccccc1)=S)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3487 |
| logD: | 2.2533 |
| logSw: | -2.6045 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.73 |
| InChI Key: | XBONJICURVDWBH-UHFFFAOYSA-N |