1-{1-[4-(diphenylamino)-6-(pyrrolidin-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-(diphenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazol-4-yl}ethan-1-one
1-{1-[4-(diphenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | 8015-1027 |
| Compound Name: | 1-{1-[4-(diphenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazol-4-yl}ethan-1-one |
| Molecular Weight: | 440.51 |
| Molecular Formula: | C24 H24 N8 O |
| Smiles: | CC(c1c(C)n(c2nc(nc(n2)N(c2ccccc2)c2ccccc2)N2CCCC2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8742 |
| logD: | 4.8742 |
| logSw: | -4.5453 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.049 |
| InChI Key: | KMLLHTISSSBXGJ-UHFFFAOYSA-N |