N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide
N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
| Compound ID: | 4334-0856 |
| Compound Name: | N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide |
| Molecular Weight: | 402.38 |
| Molecular Formula: | C17 H14 N4 O6 S |
| Smiles: | C1CC(CN2C(c3ccc(cc3C2=O)C(Nc2ncc([N+]([O-])=O)s2)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3804 |
| logD: | -0.9256 |
| logSw: | -2.9818 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.538 |
| InChI Key: | QWVLTYHZGVVMPD-SNVBAGLBSA-N |