N-(3-chloro-4-methoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
N-(3-chloro-4-methoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | Y042-8931 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C23 H24 Cl N3 O3 |
| Smiles: | COc1ccc(cc1[Cl])NC([C@H]1CC[C@@H](CC1)CN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.77 |
| logD: | 3.7686 |
| logSw: | -4.1169 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.253 |
| InChI Key: | XQVMXHXLRKLALN-UHFFFAOYSA-N |