N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | F341-1953 |
| Compound Name: | N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-4-fluorobenzamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C24 H28 F N5 O |
| Smiles: | Cc1cc(C)cc(c1)/N=C(\NCCc1c(C)nn(C)c1C)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7919 |
| logD: | 3.1311 |
| logSw: | -4.0936 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.532 |
| InChI Key: | XVLGOMCECZXAQQ-UHFFFAOYSA-N |