1-(1-{4-[benzyl(methyl)amino]-6-(1H-pyrrol-1-yl)-1,3,5-triazin-2-yl}-5-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one
Chemical Structure Depiction of
1-(1-{4-[benzyl(methyl)amino]-6-(1H-pyrrol-1-yl)-1,3,5-triazin-2-yl}-5-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one
1-(1-{4-[benzyl(methyl)amino]-6-(1H-pyrrol-1-yl)-1,3,5-triazin-2-yl}-5-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8018-1834 |
| Compound Name: | 1-(1-{4-[benzyl(methyl)amino]-6-(1H-pyrrol-1-yl)-1,3,5-triazin-2-yl}-5-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one |
| Molecular Weight: | 388.43 |
| Molecular Formula: | C20 H20 N8 O |
| Smiles: | CC(c1c(C)n(c2nc(nc(n2)n2cccc2)N(C)Cc2ccccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0632 |
| logD: | 4.0632 |
| logSw: | -4.1248 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.496 |
| InChI Key: | IWXHRFHOSDHHPS-UHFFFAOYSA-N |