3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
Chemical Structure Depiction of
3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | F036-1165 |
| Compound Name: | 3-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-4-fluorobenzamide |
| Molecular Weight: | 494.95 |
| Molecular Formula: | C26 H24 Cl F N4 O3 |
| Smiles: | COc1ccc(cc1OC)/N=C(\NCCc1c[nH]c2ccccc12)NC(c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8062 |
| logD: | 4.4376 |
| logSw: | -5.0913 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.825 |
| InChI Key: | KKBWTZQDHRHHJD-UHFFFAOYSA-N |