3-nitro-N-octyl-4-{[(oxolan-2-yl)methyl]amino}benzamide
Chemical Structure Depiction of
3-nitro-N-octyl-4-{[(oxolan-2-yl)methyl]amino}benzamide
3-nitro-N-octyl-4-{[(oxolan-2-yl)methyl]amino}benzamide
Compound characteristics
| Compound ID: | K781-6074 |
| Compound Name: | 3-nitro-N-octyl-4-{[(oxolan-2-yl)methyl]amino}benzamide |
| Molecular Weight: | 377.48 |
| Molecular Formula: | C20 H31 N3 O4 |
| Smiles: | CCCCCCCCNC(c1ccc(c(c1)[N+]([O-])=O)NCC1CCCO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.36 |
| logD: | 4.36 |
| logSw: | -4.3436 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.036 |
| InChI Key: | UQVKRANTZVUXQQ-QGZVFWFLSA-N |