methyl 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxylate
methyl 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | Y040-9085 |
| Compound Name: | methyl 4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carboxylate |
| Molecular Weight: | 316.35 |
| Molecular Formula: | C17 H20 N2 O4 |
| Smiles: | COC([C@@H]1CC[C@H](CC1)CN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1403 |
| logD: | 3.1395 |
| logSw: | -3.5524 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.846 |
| InChI Key: | YIOZSDQZKFERKL-UHFFFAOYSA-N |