{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Chemical Structure Depiction of
{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Compound characteristics
| Compound ID: | 2969-0368 |
| Compound Name: | {[3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile |
| Molecular Weight: | 317.43 |
| Molecular Formula: | C15 H15 N3 O S2 |
| Smiles: | CC(=C)CN1C(=Nc2c(C1=O)c1CCCc1s2)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 3.1626 |
| logD: | 3.1626 |
| logSw: | -3.1246 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.995 |
| InChI Key: | MICAXTDDXRIIEZ-UHFFFAOYSA-N |