N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-2-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-2-fluorobenzamide
N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-2-fluorobenzamide
Compound characteristics
| Compound ID: | F036-0255 |
| Compound Name: | N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-2-fluorobenzamide |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C26 H25 F N4 O3 |
| Smiles: | COc1ccc(cc1OC)/N=C(\NCCc1c[nH]c2ccccc12)NC(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2492 |
| logD: | 4.0148 |
| logSw: | -4.2723 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.825 |
| InChI Key: | JYUANLIPZBJBJW-UHFFFAOYSA-N |