N-(2,4-dimethoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
N-(2,4-dimethoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | Y040-2858 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C24 H27 N3 O4 |
| Smiles: | COc1ccc(c(c1)OC)NC([C@@H]1CC[C@H](CC1)CN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3032 |
| logD: | 3.3026 |
| logSw: | -3.8898 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.099 |
| InChI Key: | XEMNAVFVVNBJFO-UHFFFAOYSA-N |