3-(2-phenylethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(2-phenylethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-(2-phenylethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | C688-1057 |
Compound Name: | 3-(2-phenylethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 480.51 |
Molecular Formula: | C26 H19 F3 N2 O2 S |
Smiles: | C(CN1C(c2c(c3ccccc3s2)N(Cc2cccc(c2)C(F)(F)F)C1=O)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 6.7097 |
logD: | 6.7097 |
logSw: | -6.5169 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 33.149 |
InChI Key: | GCIAOKRLQCUBAE-UHFFFAOYSA-N |