5-methyl-3-(3-methylbutyl)-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
5-methyl-3-(3-methylbutyl)-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
5-methyl-3-(3-methylbutyl)-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L105-0203 |
| Compound Name: | 5-methyl-3-(3-methylbutyl)-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 485.57 |
| Molecular Formula: | C26 H26 F3 N3 O S |
| Smiles: | CC(C)CCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.5227 |
| logD: | 6.5227 |
| logSw: | -5.6636 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1947 |
| InChI Key: | PTZYPQHOTXDJGZ-UHFFFAOYSA-N |