2-(2H-1,3-benzodioxol-5-yl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine
2-(2H-1,3-benzodioxol-5-yl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine
Compound characteristics
| Compound ID: | 8001-9307 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C19 H21 N O3 |
| Smiles: | CCC1(CC)c2ccccc2NC(c2ccc3c(c2)OCO3)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7247 |
| logD: | 4.7246 |
| logSw: | -4.5326 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.405 |
| InChI Key: | XGGAVEYTHPMTQM-SFHVURJKSA-N |