7-chloro-9-methoxy-N-propyl-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-propyl-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-propyl-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0718 |
| Compound Name: | 7-chloro-9-methoxy-N-propyl-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 293.75 |
| Molecular Formula: | C15 H16 Cl N O3 |
| Smiles: | CCCNC(C1C=COc2c(C=1)cc(cc2OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5534 |
| logD: | 3.5534 |
| logSw: | -3.8099 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.704 |
| InChI Key: | XYYDTWWYFCEKSQ-UHFFFAOYSA-N |