4-tert-butyl-N-{N'-(2-ethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N'-(2-ethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
4-tert-butyl-N-{N'-(2-ethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
Compound ID: | F340-1414 |
Compound Name: | 4-tert-butyl-N-{N'-(2-ethoxyphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
Molecular Weight: | 461.61 |
Molecular Formula: | C27 H35 N5 O2 |
Smiles: | CCOc1ccccc1/N=C(\NCc1c(C)nn(C)c1C)NC(c1ccc(cc1)C(C)(C)C)=O |
Stereo: | ACHIRAL |
logP: | 4.7503 |
logD: | 4.4694 |
logSw: | -4.4117 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.203 |
InChI Key: | UIJBQASFUZUFFM-UHFFFAOYSA-N |