8-ethyl-2-[4-(methylcarbamothioyl)piperazin-1-yl]-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Chemical Structure Depiction of
8-ethyl-2-[4-(methylcarbamothioyl)piperazin-1-yl]-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
8-ethyl-2-[4-(methylcarbamothioyl)piperazin-1-yl]-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Compound characteristics
| Compound ID: | 8014-9447 |
| Compound Name: | 8-ethyl-2-[4-(methylcarbamothioyl)piperazin-1-yl]-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid |
| Molecular Weight: | 376.44 |
| Molecular Formula: | C16 H20 N6 O3 S |
| Smiles: | CCN1C=C(C(O)=O)C(c2cnc(nc12)N1CCN(CC1)C(NC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5665 |
| logD: | -2.7031 |
| logSw: | -2.325 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.173 |
| InChI Key: | GQQKICLSFCMGJR-UHFFFAOYSA-N |