4-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
4-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F036-1590 |
| Compound Name: | 4-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C27 H27 F N4 O |
| Smiles: | CC(C)c1ccc(cc1)/N=C(/NCCc1c[nH]c2ccccc12)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.796 |
| logD: | 5.4424 |
| logSw: | -5.8861 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.564 |
| InChI Key: | JKEMKXREMUPQQP-UHFFFAOYSA-N |