N~2~,N~4~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
N~2~,N~4~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-nitropyrimidine-2,4-diamine
N~2~,N~4~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | 8018-2408 |
| Compound Name: | N~2~,N~4~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 437.41 |
| Molecular Formula: | C21 H19 N5 O6 |
| Smiles: | Cc1c(c(Nc2ccc3c(c2)OCCO3)nc(Nc2ccc3c(c2)OCCO3)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6912 |
| logD: | 2.691 |
| logSw: | -3.0839 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.411 |
| InChI Key: | CMLJKBFMFOYXPV-UHFFFAOYSA-N |