1-[2-(4-chlorophenyl)-2-oxoethyl]-3-(3,4-dimethylphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
1-[2-(4-chlorophenyl)-2-oxoethyl]-3-(3,4-dimethylphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
1-[2-(4-chlorophenyl)-2-oxoethyl]-3-(3,4-dimethylphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C200-0536 |
| Compound Name: | 1-[2-(4-chlorophenyl)-2-oxoethyl]-3-(3,4-dimethylphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 464.97 |
| Molecular Formula: | C25 H21 Cl N2 O3 S |
| Smiles: | Cc1ccc(cc1C)N1C(c2c3CCCc3sc2N(CC(c2ccc(cc2)[Cl])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7232 |
| logD: | 5.7232 |
| logSw: | -6.1403 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.64 |
| InChI Key: | RQLZJLYOIGWNCA-UHFFFAOYSA-N |