butyl {2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetate
Chemical Structure Depiction of
butyl {2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetate
butyl {2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetate
Compound characteristics
| Compound ID: | Y021-2928 |
| Compound Name: | butyl {2-[(3-methylbutyl)sulfanyl]-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-6-yl}acetate |
| Molecular Weight: | 381.49 |
| Molecular Formula: | C18 H27 N3 O4 S |
| Smiles: | CCCCOC(CC1CC2=C(NC(=NC2=O)SCCC(C)C)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6271 |
| logD: | 0.0607 |
| logSw: | -2.7556 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.921 |
| InChI Key: | ORTBQDWPBMFUPL-LBPRGKRZSA-N |