3-cyclopropyl-5-methyl-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
3-cyclopropyl-5-methyl-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
3-cyclopropyl-5-methyl-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L105-0143 |
| Compound Name: | 3-cyclopropyl-5-methyl-7-phenyl-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 455.5 |
| Molecular Formula: | C24 H20 F3 N3 O S |
| Smiles: | Cn1cc(c2ccccc2)c2c1C(N(C1CC1)C(=N2)SCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3938 |
| logD: | 5.3938 |
| logSw: | -5.3924 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.4974 |
| InChI Key: | DKNKODDFASAJPH-UHFFFAOYSA-N |