3-(4-chlorophenyl)-1-[(pyridin-3-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-[(pyridin-3-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-(4-chlorophenyl)-1-[(pyridin-3-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0390 |
| Compound Name: | 3-(4-chlorophenyl)-1-[(pyridin-3-yl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 409.89 |
| Molecular Formula: | C21 H16 Cl N3 O2 S |
| Smiles: | C1Cc2c3C(N(C(N(Cc4cccnc4)c3sc2C1)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.928 |
| logD: | 3.9271 |
| logSw: | -4.8763 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.911 |
| InChI Key: | BQOFMDUFTQXKSS-UHFFFAOYSA-N |