N-(2-methoxyphenyl)-3-nitro-4-[(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)sulfanyl]benzamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-3-nitro-4-[(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)sulfanyl]benzamide
N-(2-methoxyphenyl)-3-nitro-4-[(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)sulfanyl]benzamide
Compound characteristics
| Compound ID: | K781-3286 |
| Compound Name: | N-(2-methoxyphenyl)-3-nitro-4-[(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)sulfanyl]benzamide |
| Molecular Weight: | 452.49 |
| Molecular Formula: | C22 H20 N4 O5 S |
| Smiles: | COc1ccccc1NC(c1ccc(c(c1)[N+]([O-])=O)SCC(NCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1628 |
| logD: | 3.1431 |
| logSw: | -3.6827 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.086 |
| InChI Key: | QZQBXSZBDCOQPO-UHFFFAOYSA-N |