4-tert-butyl-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
4-tert-butyl-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1437 |
| Compound Name: | 4-tert-butyl-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 445.61 |
| Molecular Formula: | C27 H35 N5 O |
| Smiles: | Cc1cc(C)cc(c1)/N=C(\NCc1c(C)nn(C)c1C)NC(c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4359 |
| logD: | 4.1175 |
| logSw: | -5.3724 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.691 |
| InChI Key: | XUXRRTNKRLTSNW-UHFFFAOYSA-N |