4-tert-butyl-N-{N'-(3,4-dimethoxyphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N'-(3,4-dimethoxyphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
4-tert-butyl-N-{N'-(3,4-dimethoxyphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-3617 |
| Compound Name: | 4-tert-butyl-N-{N'-(3,4-dimethoxyphenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C28 H37 N5 O3 |
| Smiles: | CCCn1cc(CN\C(NC(c2ccc(cc2)C(C)(C)C)=O)=N/c2ccc(c(c2)OC)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9139 |
| logD: | 4.4989 |
| logSw: | -4.47 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.221 |
| InChI Key: | CNELIXVCSGDJBL-UHFFFAOYSA-N |