N-benzyl-4-{[2,4-dioxo-1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-{[2,4-dioxo-1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}cyclohexane-1-carboxamide
N-benzyl-4-{[2,4-dioxo-1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0124 |
| Compound Name: | N-benzyl-4-{[2,4-dioxo-1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | CC(C)NC(CN1C(N(CC2CCC(CC2)C(NCc2ccccc2)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4345 |
| logD: | 3.4345 |
| logSw: | -3.7509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.608 |
| InChI Key: | HXWBTHNRYJCFLV-UHFFFAOYSA-N |