N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0531 |
| Compound Name: | N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[(3-methoxyphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C23 H36 N4 O3 |
| Smiles: | CCN1CCN(CCNC(C2CCCCC(N2Cc2cccc(c2)OC)=O)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3169 |
| logD: | 0.5243 |
| logSw: | -2.0933 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.297 |
| InChI Key: | IUNIJMSNTYMCKI-NRFANRHFSA-N |