N-[(2,5-difluorophenyl)methyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[(2,5-difluorophenyl)methyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
N-[(2,5-difluorophenyl)methyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0484 |
| Compound Name: | N-[(2,5-difluorophenyl)methyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 402.44 |
| Molecular Formula: | C22 H24 F2 N2 O3 |
| Smiles: | COc1cccc(CN2C(CCCCC2=O)C(NCc2cc(ccc2F)F)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3276 |
| logD: | 3.3276 |
| logSw: | -3.5484 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.936 |
| InChI Key: | DCBXTHKDEKZQHB-FQEVSTJZSA-N |