1-benzyl-N-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
1-benzyl-N-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0633 |
| Compound Name: | 1-benzyl-N-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C22 H26 N2 O3 |
| Smiles: | COc1cccc(CNC(C2CCCCC(N2Cc2ccccc2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7884 |
| logD: | 2.7884 |
| logSw: | -3.2857 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.936 |
| InChI Key: | VVUOOEAHBSKGKV-FQEVSTJZSA-N |