3-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-4-methylbenzamide
3-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | F036-1420 |
| Compound Name: | 3-fluoro-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C26 H25 F N4 O2 |
| Smiles: | Cc1ccc(cc1F)C(NC(/NCCc1c[nH]c2ccccc12)=N/c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.442 |
| logD: | 5.3011 |
| logSw: | -5.6354 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.107 |
| InChI Key: | QDUTXYJGAAJQET-UHFFFAOYSA-N |