7-acetyl-3-(3-chloro-2-methylphenyl)-1-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-acetyl-3-(3-chloro-2-methylphenyl)-1-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
7-acetyl-3-(3-chloro-2-methylphenyl)-1-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C728-0719 |
| Compound Name: | 7-acetyl-3-(3-chloro-2-methylphenyl)-1-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 497.97 |
| Molecular Formula: | C25 H21 Cl F N3 O3 S |
| Smiles: | CC(N1CCc2c3C(N(C(N(Cc4ccccc4F)c3sc2C1)=O)c1cccc(c1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9088 |
| logD: | 4.9088 |
| logSw: | -5.0714 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.856 |
| InChI Key: | PKQUIZUIKHBZAL-UHFFFAOYSA-N |