(4-{[4-amino-6-(2,4-dimethoxyanilino)-1,3,5-triazin-2-yl]methyl}piperazin-1-yl)(furan-2-yl)methanone
Chemical Structure Depiction of
(4-{[4-amino-6-(2,4-dimethoxyanilino)-1,3,5-triazin-2-yl]methyl}piperazin-1-yl)(furan-2-yl)methanone
(4-{[4-amino-6-(2,4-dimethoxyanilino)-1,3,5-triazin-2-yl]methyl}piperazin-1-yl)(furan-2-yl)methanone
Compound characteristics
| Compound ID: | Y020-8276 |
| Compound Name: | (4-{[4-amino-6-(2,4-dimethoxyanilino)-1,3,5-triazin-2-yl]methyl}piperazin-1-yl)(furan-2-yl)methanone |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C21 H25 N7 O4 |
| Smiles: | COc1ccc(c(c1)OC)Nc1nc(CN2CCN(CC2)C(c2ccco2)=O)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.7495 |
| logD: | 1.7017 |
| logSw: | -2.372 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.852 |
| InChI Key: | KBRUFKWNAFTISK-UHFFFAOYSA-N |