N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | F340-0756 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 482.42 |
| Molecular Formula: | C24 H28 Br N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cc(C)cc(C)c2)=O)=N/c2cccc(c2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.951 |
| logD: | 4.7228 |
| logSw: | -4.665 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.129 |
| InChI Key: | HOKRNOXBWXOZFJ-UHFFFAOYSA-N |