3-(4-ethoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-(4-ethoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C688-1014 |
| Compound Name: | 3-(4-ethoxyphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 496.51 |
| Molecular Formula: | C26 H19 F3 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2c(c3ccccc3s2)N(Cc2cccc(c2)C(F)(F)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2222 |
| logD: | 6.2222 |
| logSw: | -5.8447 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.683 |
| InChI Key: | SBNLKJGGOHVPHH-UHFFFAOYSA-N |