3-(4-chlorophenyl)-1-(3,3-dimethyl-2-oxobutyl)-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-(3,3-dimethyl-2-oxobutyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-(4-chlorophenyl)-1-(3,3-dimethyl-2-oxobutyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0394 |
| Compound Name: | 3-(4-chlorophenyl)-1-(3,3-dimethyl-2-oxobutyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 416.93 |
| Molecular Formula: | C21 H21 Cl N2 O3 S |
| Smiles: | CC(C)(C)C(CN1C(N(C(c2c3CCCc3sc12)=O)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5619 |
| logD: | 4.5619 |
| logSw: | -4.9696 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.912 |
| InChI Key: | QGUCQVYZDOPYTQ-UHFFFAOYSA-N |