methyl 4-(2-{2-[(azepan-1-yl)methyl]-5-methoxy-4-oxopyridin-1(4H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{2-[(azepan-1-yl)methyl]-5-methoxy-4-oxopyridin-1(4H)-yl}acetamido)benzoate
methyl 4-(2-{2-[(azepan-1-yl)methyl]-5-methoxy-4-oxopyridin-1(4H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | G876-0319 |
| Compound Name: | methyl 4-(2-{2-[(azepan-1-yl)methyl]-5-methoxy-4-oxopyridin-1(4H)-yl}acetamido)benzoate |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C23 H29 N3 O5 |
| Smiles: | COC1=CN(CC(Nc2ccc(cc2)C(=O)OC)=O)C(CN2CCCCCC2)=CC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.4319 |
| logD: | 2.222 |
| logSw: | -2.8255 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.732 |
| InChI Key: | ZCBJEOFIJSOBFO-UHFFFAOYSA-N |