5-[(2,5-dimethylphenyl)methyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Chemical Structure Depiction of
5-[(2,5-dimethylphenyl)methyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
5-[(2,5-dimethylphenyl)methyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 8015-2721 |
| Compound Name: | 5-[(2,5-dimethylphenyl)methyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one |
| Molecular Weight: | 260.36 |
| Molecular Formula: | C14 H16 N2 O S |
| Smiles: | CC1=C(Cc2cc(C)ccc2C)C(NC(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6434 |
| logD: | 3.605 |
| logSw: | -3.7494 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.484 |
| InChI Key: | QEXVFJQWBGFFOM-UHFFFAOYSA-N |