7-[4-chloro-3-(trifluoromethyl)phenyl]-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1,3]benzoxazine
Chemical Structure Depiction of
7-[4-chloro-3-(trifluoromethyl)phenyl]-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1,3]benzoxazine
7-[4-chloro-3-(trifluoromethyl)phenyl]-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1,3]benzoxazine
Compound characteristics
| Compound ID: | C276-0045 |
| Compound Name: | 7-[4-chloro-3-(trifluoromethyl)phenyl]-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1,3]benzoxazine |
| Molecular Weight: | 357.71 |
| Molecular Formula: | C16 H11 Cl F3 N O3 |
| Smiles: | C1c2cc3c(cc2OCN1c1ccc(c(c1)C(F)(F)F)[Cl])OCO3 |
| Stereo: | ACHIRAL |
| logP: | 4.9273 |
| logD: | 4.9273 |
| logSw: | -5.1454 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.6582 |
| InChI Key: | HMXLQHSBVJOVSL-UHFFFAOYSA-N |