3-{3-[ethyl(3-methylphenyl)amino]propyl}-2-sulfanylidene-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
3-{3-[ethyl(3-methylphenyl)amino]propyl}-2-sulfanylidene-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
3-{3-[ethyl(3-methylphenyl)amino]propyl}-2-sulfanylidene-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | K256-0059 |
| Compound Name: | 3-{3-[ethyl(3-methylphenyl)amino]propyl}-2-sulfanylidene-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C19 H22 N4 O S |
| Smiles: | CCN(CCCN1C(c2cccnc2NC1=S)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8302 |
| logD: | 3.7484 |
| logSw: | -3.7723 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.91 |
| InChI Key: | QEPWLNSGXRBATA-UHFFFAOYSA-N |