2-{[(3-bromophenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(propan-2-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(3-bromophenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(propan-2-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
2-{[(3-bromophenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(propan-2-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L105-0101 |
| Compound Name: | 2-{[(3-bromophenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(propan-2-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 468.41 |
| Molecular Formula: | C23 H22 Br N3 O S |
| Smiles: | CC(C)N1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.5684 |
| logD: | 5.5684 |
| logSw: | -5.323 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.937 |
| InChI Key: | NTRRLFPTXBHPMH-UHFFFAOYSA-N |