N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Compound characteristics
| Compound ID: | F340-0101 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide |
| Molecular Weight: | 497.44 |
| Molecular Formula: | C24 H29 Br N6 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2cccc(c2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4185 |
| logD: | 4.1999 |
| logSw: | -4.3325 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.934 |
| InChI Key: | NNOSSZGDGYONMQ-UHFFFAOYSA-N |