N-{N'-(5-chloro-2-methoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Chemical Structure Depiction of
N-{N'-(5-chloro-2-methoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
N-{N'-(5-chloro-2-methoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Compound characteristics
| Compound ID: | F340-0073 |
| Compound Name: | N-{N'-(5-chloro-2-methoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide |
| Molecular Weight: | 483.01 |
| Molecular Formula: | C25 H31 Cl N6 O2 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2cc(ccc2OC)[Cl])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9166 |
| logD: | 3.8145 |
| logSw: | -4.4344 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.867 |
| InChI Key: | NHJVGEJXXSNSTN-UHFFFAOYSA-N |