2-(butylsulfanyl)-N-(2,4-dimethylphenyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(butylsulfanyl)-N-(2,4-dimethylphenyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
2-(butylsulfanyl)-N-(2,4-dimethylphenyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | J023-0409 |
Compound Name: | 2-(butylsulfanyl)-N-(2,4-dimethylphenyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
Molecular Weight: | 400.5 |
Molecular Formula: | C20 H24 N4 O3 S |
Smiles: | CCCCSC1NC(C2C(CC(NC=2N=1)=O)C(Nc1ccc(C)cc1C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.712 |
logD: | 2.6983 |
logSw: | -2.999 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 80.805 |
InChI Key: | GPMPYILNHABHAF-ZDUSSCGKSA-N |