1-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
1-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C688-0944 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C25 H19 F N2 O2 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(C(c3c2c2ccccc2s3)=O)c2ccc(cc2)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1715 |
| logD: | 6.1715 |
| logSw: | -5.6326 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.559 |
| InChI Key: | RMCLHKPTRGPHLO-UHFFFAOYSA-N |