3-(3,4-dichlorophenyl)-5,6-dimethyl-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3,4-dichlorophenyl)-5,6-dimethyl-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-(3,4-dichlorophenyl)-5,6-dimethyl-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C242-1058 |
| Compound Name: | 3-(3,4-dichlorophenyl)-5,6-dimethyl-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 499.37 |
| Molecular Formula: | C23 H16 Cl2 N4 O3 S |
| Smiles: | Cc1c2C(N(C(N(CC3=CC(N4C=CC=CC4=N3)=O)c2sc1C)=O)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2068 |
| logD: | 4.2068 |
| logSw: | -4.7024 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.093 |
| InChI Key: | KVTJFJNWZLHZPQ-UHFFFAOYSA-N |