1-(azepan-1-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethan-1-one
1-(azepan-1-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | D306-0108 |
| Compound Name: | 1-(azepan-1-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 305.44 |
| Molecular Formula: | C16 H23 N3 O S |
| Smiles: | Cc1nc2CCCc2c(n1)SCC(N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9179 |
| logD: | 2.9109 |
| logSw: | -3.0074 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.793 |
| InChI Key: | FCEUATKFGFWOLV-UHFFFAOYSA-N |