ethyl (1-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}cyclohexyl)acetate
Chemical Structure Depiction of
ethyl (1-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}cyclohexyl)acetate
ethyl (1-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}cyclohexyl)acetate
Compound characteristics
| Compound ID: | F129-0133 |
| Compound Name: | ethyl (1-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}cyclohexyl)acetate |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C22 H29 N3 O5 |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NC(NC1(CCCCC1)CC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8466 |
| logD: | 2.7164 |
| logSw: | -3.5012 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.516 |
| InChI Key: | FIJDCLBMKBTVFW-UHFFFAOYSA-N |