7-chloro-N-methyl-N-phenyl-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-N-methyl-N-phenyl-1-benzoxepine-4-carboxamide
7-chloro-N-methyl-N-phenyl-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0259 |
| Compound Name: | 7-chloro-N-methyl-N-phenyl-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 311.77 |
| Molecular Formula: | C18 H14 Cl N O2 |
| Smiles: | CN(C(C1C=COc2ccc(cc2C=1)[Cl])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.195 |
| logD: | 4.195 |
| logSw: | -4.5243 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.2321 |
| InChI Key: | JTUSAHDIOZRELY-UHFFFAOYSA-N |