3-acetamido-N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L086-1479 |
| Compound Name: | 3-acetamido-N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(\NCc1ccccn1)=N/c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2089 |
| logD: | 1.5293 |
| logSw: | -2.8152 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.074 |
| InChI Key: | JVZPNFKELKZQFD-UHFFFAOYSA-N |