propan-2-yl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
propan-2-yl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
propan-2-yl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | L105-0006 |
| Compound Name: | propan-2-yl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C21 H25 N3 O3 S |
| Smiles: | CCCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCC(=O)OC(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.8633 |
| logD: | 3.8633 |
| logSw: | -3.7679 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.304 |
| InChI Key: | NFBSZUJDAPMPTI-UHFFFAOYSA-N |