N-{[1-(morpholin-4-yl)cyclohexyl]methyl}-2-oxo-2H-1-benzopyran-3-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{[1-(morpholin-4-yl)cyclohexyl]methyl}-2-oxo-2H-1-benzopyran-3-carboxamide--hydrogen chloride (1/1)
N-{[1-(morpholin-4-yl)cyclohexyl]methyl}-2-oxo-2H-1-benzopyran-3-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0134 |
| Compound Name: | N-{[1-(morpholin-4-yl)cyclohexyl]methyl}-2-oxo-2H-1-benzopyran-3-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 406.91 |
| Molecular Formula: | C21 H26 N2 O4 |
| Salt: | HCl |
| Smiles: | C1CCC(CC1)(CNC(C1=Cc2ccccc2OC1=O)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.552 |
| logD: | 2.4517 |
| logSw: | -2.8663 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.715 |
| InChI Key: | RVGBBVVCSSJHLL-UHFFFAOYSA-N |