3-(4-ethylphenyl)-1-[2-(4-fluorophenyl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-(4-ethylphenyl)-1-[2-(4-fluorophenyl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-(4-ethylphenyl)-1-[2-(4-fluorophenyl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0478 |
| Compound Name: | 3-(4-ethylphenyl)-1-[2-(4-fluorophenyl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H21 F N2 O3 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCCc3sc2N(CC(c2ccc(cc2)F)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9557 |
| logD: | 4.9557 |
| logSw: | -4.7587 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.64 |
| InChI Key: | NNAUZNBIKUABDA-UHFFFAOYSA-N |