5-methyl-3-(3-methylbutyl)-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-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-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
5-methyl-3-(3-methylbutyl)-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L105-0218 |
| Compound Name: | 5-methyl-3-(3-methylbutyl)-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 498.65 |
| Molecular Formula: | C29 H30 N4 O2 S |
| Smiles: | CC(C)CCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCc1c(C)oc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.2929 |
| logD: | 6.2929 |
| logSw: | -5.4696 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.317 |
| InChI Key: | FATBAIGDFVFZGZ-UHFFFAOYSA-N |