3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
Compound ID: | F340-2148 |
Compound Name: | 3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
Molecular Weight: | 468.4 |
Molecular Formula: | C23 H26 Br N5 O |
Smiles: | Cc1cc(C)cc(c1)/N=C(\NCc1c(C)nn(C)c1C)NC(c1cccc(c1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 4.4903 |
logD: | 3.1719 |
logSw: | -4.3916 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.691 |
InChI Key: | XNDGLQZWNSCBNY-UHFFFAOYSA-N |