4-({1-[2-(azepan-1-yl)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({1-[2-(azepan-1-yl)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
4-({1-[2-(azepan-1-yl)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0242 |
| Compound Name: | 4-({1-[2-(azepan-1-yl)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C25 H36 N4 O4 S |
| Smiles: | CCCNC(C1CCC(CC1)CN1C(c2c(ccs2)N(CC(N2CCCCCC2)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6619 |
| logD: | 3.6619 |
| logSw: | -3.5854 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.727 |
| InChI Key: | KDIKVYNQQGDSAO-UHFFFAOYSA-N |