5-methyl-3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
5-methyl-3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
5-methyl-3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L105-0224 |
| Compound Name: | 5-methyl-3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C28 H29 N5 O2 S |
| Smiles: | CC(C)CCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCc1nc(c2cccc(C)c2)no1 |
| Stereo: | ACHIRAL |
| logP: | 6.6818 |
| logD: | 6.6818 |
| logSw: | -5.5355 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.538 |
| InChI Key: | ADISPAJYZWRVQF-UHFFFAOYSA-N |