5-(4-butoxyphenyl)-2-(ethylsulfanyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
5-(4-butoxyphenyl)-2-(ethylsulfanyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-(4-butoxyphenyl)-2-(ethylsulfanyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
Compound ID: | D271-0562 |
Compound Name: | 5-(4-butoxyphenyl)-2-(ethylsulfanyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
Molecular Weight: | 387.5 |
Molecular Formula: | C20 H25 N3 O3 S |
Smiles: | CCCCOc1ccc(cc1)C1CC(NC2=C1C(N=C(N2C)SCC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1773 |
logD: | 3.0104 |
logSw: | -3.3276 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.771 |
InChI Key: | YZWBQQONPHSYFX-HNNXBMFYSA-N |