N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-[(4-methylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-[(4-methylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine
N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-[(4-methylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | 8018-5411 |
| Compound Name: | N~2~-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-[(4-methylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C17 H23 N7 O2 |
| Smiles: | CN1CCN(CC1)Cc1nc(N)nc(Nc2ccc3c(c2)OCCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.3567 |
| logD: | -0.6143 |
| logSw: | -1.9295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.64 |
| InChI Key: | MQYYSUSHCYKIQR-UHFFFAOYSA-N |