N-{N'-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-N'-(3-methylphenyl)urea
Chemical Structure Depiction of
N-{N'-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-N'-(3-methylphenyl)urea
N-{N'-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-N'-(3-methylphenyl)urea
Compound characteristics
| Compound ID: | Y021-1976 |
| Compound Name: | N-{N'-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}-N'-(3-methylphenyl)urea |
| Molecular Weight: | 441.54 |
| Molecular Formula: | C25 H27 N7 O |
| Smiles: | Cc1cccc(c1)NC(NC(/NCCc1c[nH]c2ccccc12)=N/c1nc(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5103 |
| logD: | 4.1428 |
| logSw: | -4.2667 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 80.094 |
| InChI Key: | ZKXPLNLBPOQCCQ-UHFFFAOYSA-N |