N-{N'-(4-bromophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-chlorobenzamide
Chemical Structure Depiction of
N-{N'-(4-bromophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-chlorobenzamide
N-{N'-(4-bromophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-chlorobenzamide
Compound characteristics
Compound ID: | F341-1263 |
Compound Name: | N-{N'-(4-bromophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-chlorobenzamide |
Molecular Weight: | 488.81 |
Molecular Formula: | C22 H23 Br Cl N5 O |
Smiles: | Cc1c(CCN\C(NC(c2cccc(c2)[Cl])=O)=N/c2ccc(cc2)[Br])c(C)n(C)n1 |
Stereo: | ACHIRAL |
logP: | 4.2068 |
logD: | 4.1516 |
logSw: | -4.5386 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.532 |
InChI Key: | ZICCVVGTGPTXFZ-UHFFFAOYSA-N |