3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl dimethylcarbamate
Chemical Structure Depiction of
3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl dimethylcarbamate
3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl dimethylcarbamate
Compound characteristics
| Compound ID: | 3601-0230 |
| Compound Name: | 3-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl dimethylcarbamate |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C26 H31 N O5 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2cccc(c2)OC(N(C)C)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4148 |
| logD: | 3.4148 |
| logSw: | -3.8003 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.346 |
| InChI Key: | KKWOYVBXBGCBGL-UHFFFAOYSA-N |