4-acetamido-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-acetamido-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
4-acetamido-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1753 |
| Compound Name: | 4-acetamido-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 460.58 |
| Molecular Formula: | C26 H32 N6 O2 |
| Smiles: | CC(C)c1ccc(cc1)/N=C(\NCc1c(C)nn(C)c1C)NC(c1ccc(cc1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1281 |
| logD: | 2.2271 |
| logSw: | -3.3582 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.953 |
| InChI Key: | ILZGAIHVPWSZJQ-UHFFFAOYSA-N |