4-acetamido-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
4-acetamido-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
4-acetamido-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F036-0842 |
| Compound Name: | 4-acetamido-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C27 H27 N5 O2 |
| Smiles: | CC(Nc1ccc(cc1)C(NC(/NCCc1c[nH]c2ccccc12)=N/c1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3082 |
| logD: | 3.9253 |
| logSw: | -4.3036 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 74.826 |
| InChI Key: | CMMUMWXLEJDGJO-UHFFFAOYSA-N |