4-acetamido-5-chloro-N-(cyanomethyl)-2-methoxybenzamide
Chemical Structure Depiction of
4-acetamido-5-chloro-N-(cyanomethyl)-2-methoxybenzamide
4-acetamido-5-chloro-N-(cyanomethyl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | Y031-1659 |
| Compound Name: | 4-acetamido-5-chloro-N-(cyanomethyl)-2-methoxybenzamide |
| Molecular Weight: | 281.7 |
| Molecular Formula: | C12 H12 Cl N3 O3 |
| Smiles: | CC(Nc1cc(c(cc1[Cl])C(NCC#N)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4377 |
| logD: | 1.3218 |
| logSw: | -2.8735 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.451 |
| InChI Key: | FYMGIUXSDUNISN-UHFFFAOYSA-N |