N-{N'-(3-chloro-4-fluorophenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | F340-2327 |
| Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C22 H22 Cl F2 N5 O |
| Smiles: | Cc1ccc(cc1F)C(NC(/NCc1c(C)nn(C)c1C)=N/c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0329 |
| logD: | 3.9326 |
| logSw: | -4.4835 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.691 |
| InChI Key: | ZFBQPACWPZCWEL-UHFFFAOYSA-N |