3-(3-ethoxypropyl)-5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
3-(3-ethoxypropyl)-5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
3-(3-ethoxypropyl)-5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-8008 |
| Compound Name: | 3-(3-ethoxypropyl)-5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 447.6 |
| Molecular Formula: | C26 H29 N3 O2 S |
| Smiles: | CCOCCCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.831 |
| logD: | 4.831 |
| logSw: | -4.4758 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.172 |
| InChI Key: | VSQQXNGRCHPUPD-UHFFFAOYSA-N |