tert-butyl [(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
tert-butyl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
tert-butyl [(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: | L105-0007 |
| Compound Name: | tert-butyl [(5-methyl-4-oxo-7-phenyl-3-propyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | CCCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCC(=O)OC(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.5103 |
| logD: | 4.5103 |
| logSw: | -4.2401 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.735 |
| InChI Key: | NVWJMYBJTZXWRV-UHFFFAOYSA-N |