N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0446 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C25 H32 N2 O5 |
| Smiles: | COc1cccc(CN2C(CCCCC2=O)C(NCCc2ccc(c(c2)OC)OC)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4371 |
| logD: | 2.4371 |
| logSw: | -2.7475 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.039 |
| InChI Key: | HWGHPBOMXQBQPD-NRFANRHFSA-N |