3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,3-benzoxazine
Compound characteristics
| Compound ID: | 8015-0620 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-6-chloro-3,4-dihydro-2H-1,3-benzoxazine |
| Molecular Weight: | 303.74 |
| Molecular Formula: | C16 H14 Cl N O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)N1Cc2cc(ccc2OC1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8327 |
| logD: | 2.5667 |
| logSw: | -4.2385 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.9383 |
| InChI Key: | DGDLDHDECSJLSI-UHFFFAOYSA-N |