N~2~-(4-ethoxyphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(4-ethoxyphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
N~2~-(4-ethoxyphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | Y020-0745 |
| Compound Name: | N~2~-(4-ethoxyphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H26 F N7 O |
| Smiles: | CCOc1ccc(cc1)Nc1nc(CN2CCN(CC2)c2ccc(cc2)F)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.721 |
| logD: | 3.6996 |
| logSw: | -4.0201 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.725 |
| InChI Key: | ITUBXIDUDYNJKQ-UHFFFAOYSA-N |