3-acetamido-N-{N'-(3,4-dimethylphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3,4-dimethylphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3,4-dimethylphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L087-0321 |
| Compound Name: | 3-acetamido-N-{N'-(3,4-dimethylphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C25 H27 N5 O2 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCc1cccnc1)=N/c1ccc(C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0677 |
| logD: | 2.4353 |
| logSw: | -2.9742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.933 |
| InChI Key: | CTKGXOKUFGWLSQ-UHFFFAOYSA-N |