N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,5-dimethylbenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | F341-2023 |
| Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C24 H27 Cl F N5 O |
| Smiles: | Cc1cc(C)cc(c1)C(NC(/NCCc1c(C)nn(C)c1C)=N/c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3349 |
| logD: | 4.2608 |
| logSw: | -4.5682 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.532 |
| InChI Key: | KHDUMZRJKYDQSA-UHFFFAOYSA-N |