N-{N'-(3-chloro-4-fluorophenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-fluorobenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | F340-3461 |
| Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-fluorobenzamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C22 H22 Cl F2 N5 O |
| Smiles: | CCCn1cc(CN\C(NC(c2ccccc2F)=O)=N/c2ccc(c(c2)[Cl])F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0395 |
| logD: | 4.0208 |
| logSw: | -4.5097 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.96 |
| InChI Key: | CTPKDWFYJAXWSH-UHFFFAOYSA-N |