5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-7993 |
| Compound Name: | 5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 401.53 |
| Molecular Formula: | C24 H23 N3 O S |
| Smiles: | Cc1ccc(CSC2=Nc3c(cn(C)c3C(N2CC=C)=O)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.819 |
| logD: | 4.819 |
| logSw: | -4.5111 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1947 |
| InChI Key: | GGXMRXVUXIGSEN-UHFFFAOYSA-N |