4-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
4-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F036-1969 |
| Compound Name: | 4-(2,5-dimethyl-1H-pyrrol-1-yl)-N-{N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C30 H28 F N5 O |
| Smiles: | Cc1ccc(C)n1c1ccc(cc1)C(NC(/NCCc1c[nH]c2ccccc12)=N/c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5122 |
| logD: | 5.4679 |
| logSw: | -5.6837 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.452 |
| InChI Key: | KLTIQQGZIRYPOU-UHFFFAOYSA-N |