N-[(4-methoxyphenyl)methyl]-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-[(4-methoxyphenyl)methyl]-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
Compound ID: | S534-0223 |
Compound Name: | N-[(4-methoxyphenyl)methyl]-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
Molecular Weight: | 345.48 |
Molecular Formula: | C20 H31 N3 O2 |
Smiles: | COc1ccc(CNC(N2CCCCCC2CN2CCCC2)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8034 |
logD: | -0.6672 |
logSw: | -3.0914 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.649 |
InChI Key: | KYROVMSXTXDUQP-GOSISDBHSA-N |