N-{N'-(3-bromophenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
N-{N'-(3-bromophenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | F341-1044 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide |
| Molecular Weight: | 482.42 |
| Molecular Formula: | C24 H28 Br N5 O |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2cccc(C)c2)=O)=N/c2cccc(c2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5933 |
| logD: | 4.5279 |
| logSw: | -4.327 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.971 |
| InChI Key: | PNRBTJGGABNCGY-UHFFFAOYSA-N |