3,4-diethoxy-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-methylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
3,4-diethoxy-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-methylphenyl)carbamimidoyl}benzamide
3,4-diethoxy-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-methylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-0604 |
| Compound Name: | 3,4-diethoxy-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-methylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C27 H35 N5 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccc(c(c2)OCC)OCC)=O)=N/c2ccc(C)cc2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6663 |
| logD: | 2.624 |
| logSw: | -3.8775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.55 |
| InChI Key: | BBQPAAOPYWMJNY-UHFFFAOYSA-N |