7-methyl-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-methyl-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
7-methyl-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D547-0074 |
| Compound Name: | 7-methyl-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C22 H22 N2 O3 |
| Smiles: | Cc1ccc2c(C=C(C=CO2)C(Nc2ccc(cc2)N2CCOCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.1552 |
| logD: | 4.155 |
| logSw: | -4.1684 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.315 |
| InChI Key: | QFLAJTZYUJTYHV-UHFFFAOYSA-N |