6-butyl-1,3-dimethyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-butyl-1,3-dimethyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
6-butyl-1,3-dimethyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G721-0169 |
| Compound Name: | 6-butyl-1,3-dimethyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C25 H31 N5 O3 S |
| Smiles: | CCCCc1cnc2c(C(N(C)C(N2C)=O)=O)c1SCC(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8814 |
| logD: | 3.8812 |
| logSw: | -3.8251 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.143 |
| InChI Key: | BVISBYXXYGLZKB-UHFFFAOYSA-N |