1-[3-(4-methoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1,2-benzoxazol-6-yl]ethan-1-one
Chemical Structure Depiction of
1-[3-(4-methoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1,2-benzoxazol-6-yl]ethan-1-one
1-[3-(4-methoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1,2-benzoxazol-6-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8018-6369 |
| Compound Name: | 1-[3-(4-methoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1,2-benzoxazol-6-yl]ethan-1-one |
| Molecular Weight: | 285.34 |
| Molecular Formula: | C17 H19 N O3 |
| Smiles: | CC(C1CC2CC1C1C2C(c2ccc(cc2)OC)=NO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2727 |
| logD: | 3.2727 |
| logSw: | -3.483 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.993 |
| InChI Key: | WNPKGVMNDDEPNI-UHFFFAOYSA-N |