8-ethyl-2-{4-[(naphthalen-1-yl)carbamothioyl]piperazin-1-yl}-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Chemical Structure Depiction of
8-ethyl-2-{4-[(naphthalen-1-yl)carbamothioyl]piperazin-1-yl}-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
8-ethyl-2-{4-[(naphthalen-1-yl)carbamothioyl]piperazin-1-yl}-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Compound characteristics
| Compound ID: | 6425-0036 |
| Compound Name: | 8-ethyl-2-{4-[(naphthalen-1-yl)carbamothioyl]piperazin-1-yl}-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid |
| Molecular Weight: | 488.57 |
| Molecular Formula: | C25 H24 N6 O3 S |
| Smiles: | CCN1C=C(C(O)=O)C(c2cnc(nc12)N1CCN(CC1)C(Nc1cccc2ccccc12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2274 |
| logD: | 0.0908 |
| logSw: | -3.079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.459 |
| InChI Key: | WDTLHAROMWRSEL-UHFFFAOYSA-N |