N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[(oxolan-2-yl)methyl]glycyl}amino)benzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[(oxolan-2-yl)methyl]glycyl}amino)benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[(oxolan-2-yl)methyl]glycyl}amino)benzamide
Compound characteristics
| Compound ID: | C284-0252 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[(oxolan-2-yl)methyl]glycyl}amino)benzamide |
| Molecular Weight: | 456.45 |
| Molecular Formula: | C22 H24 N4 O7 |
| Smiles: | C1CC(CNCC(Nc2ccc(cc2C(Nc2ccc3c(c2)OCCO3)=O)[N+]([O-])=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6834 |
| logD: | 0.6463 |
| logSw: | -2.477 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.406 |
| InChI Key: | ZSDDPDDREIXGRJ-MRXNPFEDSA-N |