N-{N'-(3-chloro-2-methylphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-2-methylphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
N-{N'-(3-chloro-2-methylphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | F340-2827 |
| Compound Name: | N-{N'-(3-chloro-2-methylphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 452 |
| Molecular Formula: | C25 H30 Cl N5 O |
| Smiles: | CCCn1cc(CN\C(NC(c2cc(C)cc(C)c2)=O)=N/c2cccc(c2C)[Cl])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2444 |
| logD: | 5.1627 |
| logSw: | -5.7562 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.262 |
| InChI Key: | PIMDZYOXSZWEPB-UHFFFAOYSA-N |