N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
Compound ID: | L086-1026 |
Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
Molecular Weight: | 396.85 |
Molecular Formula: | C21 H18 Cl F N4 O |
Smiles: | Cc1ccc(cc1)C(NC(/NCc1ccccn1)=N/c1ccc(c(c1)[Cl])F)=O |
Stereo: | ACHIRAL |
logP: | 4.1304 |
logD: | 4.0639 |
logSw: | -4.4746 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.394 |
InChI Key: | JLEYPRFJCOXPBX-UHFFFAOYSA-N |