1-[(furan-2-yl)methyl]-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-[(furan-2-yl)methyl]-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-[(furan-2-yl)methyl]-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0722 |
| Compound Name: | 1-[(furan-2-yl)methyl]-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C21 H20 N2 O3 S |
| Smiles: | [H]C([H])(C(c1ccc(C)cc1)=O)SC1C2CCCC=2N(Cc2ccco2)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6236 |
| logD: | 3.6236 |
| logSw: | -3.76 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.481 |
| InChI Key: | RYJXECJTXQIWRB-UHFFFAOYSA-N |