3-tert-butyl-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-tert-butyl-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-tert-butyl-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | E754-0631 |
| Compound Name: | 3-tert-butyl-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C19 H23 N O3 |
| Smiles: | CC(C)(C)N1Cc2c(ccc3C4CCCCC=4C(=O)Oc23)OC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2446 |
| logD: | 3.0389 |
| logSw: | -4.3186 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.036 |
| InChI Key: | IGPPMYDMLPIEPD-UHFFFAOYSA-N |