2-[2-(2H-1,3-benzodioxol-5-yl)-3-nitropropylidene]-1,3,3-trimethyl-2,3-dihydro-1H-indole
Chemical Structure Depiction of
2-[2-(2H-1,3-benzodioxol-5-yl)-3-nitropropylidene]-1,3,3-trimethyl-2,3-dihydro-1H-indole
2-[2-(2H-1,3-benzodioxol-5-yl)-3-nitropropylidene]-1,3,3-trimethyl-2,3-dihydro-1H-indole
Compound characteristics
| Compound ID: | 3333-3172 |
| Compound Name: | 2-[2-(2H-1,3-benzodioxol-5-yl)-3-nitropropylidene]-1,3,3-trimethyl-2,3-dihydro-1H-indole |
| Molecular Weight: | 366.42 |
| Molecular Formula: | C21 H22 N2 O4 |
| Smiles: | CC1(C)/C(=C/C(C[N+]([O-])=O)c2ccc3c(c2)OCO3)N(C)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2797 |
| logD: | 4.2218 |
| logSw: | -4.4237 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.002 |
| InChI Key: | IVZMWOLSZWXFMQ-UWOKGBPVSA-N |