N-{N'-(2,3-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-{N'-(2,3-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
N-{N'-(2,3-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | F036-1912 |
| Compound Name: | N-{N'-(2,3-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C27 H27 F N4 O |
| Smiles: | Cc1ccc(cc1F)C(NC(/NCCc1c[nH]c2ccccc12)=N/c1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0732 |
| logD: | 5.6561 |
| logSw: | -5.6736 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 50.866 |
| InChI Key: | MRVDOWZCNCGVGL-UHFFFAOYSA-N |