N~2~-(2,4-dimethylphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(2,4-dimethylphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
N~2~-(2,4-dimethylphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
Compound characteristics
Compound ID: | Y021-1730 |
Compound Name: | N~2~-(2,4-dimethylphenyl)-6-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine |
Molecular Weight: | 407.49 |
Molecular Formula: | C22 H26 F N7 |
Smiles: | Cc1ccc(c(C)c1)Nc1nc(CN2CCN(CC2)c2ccc(cc2)F)nc(N)n1 |
Stereo: | ACHIRAL |
logP: | 4.0646 |
logD: | 4.0432 |
logSw: | -4.1084 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 67.903 |
InChI Key: | ODRIHCJUJUPYBT-UHFFFAOYSA-N |