ethyl 4-{[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Chemical Structure Depiction of
ethyl 4-{[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
ethyl 4-{[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F129-0234 |
| Compound Name: | ethyl 4-{[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C25 H27 N3 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(NC1=C(c2ccccc2OC1=O)NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0972 |
| logD: | 5.0923 |
| logSw: | -4.824 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.575 |
| InChI Key: | MSNNQQHEPUCDQI-UHFFFAOYSA-N |