9-(4-hydroxy-3,5-dimethoxyphenyl)-6,6-dimethyl-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
Chemical Structure Depiction of
9-(4-hydroxy-3,5-dimethoxyphenyl)-6,6-dimethyl-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
9-(4-hydroxy-3,5-dimethoxyphenyl)-6,6-dimethyl-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one
Compound characteristics
| Compound ID: | 8538-0031 |
| Compound Name: | 9-(4-hydroxy-3,5-dimethoxyphenyl)-6,6-dimethyl-6,7,9,10-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-b][1,4]benzodiazepin-8(5H)-one |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C19 H22 N4 O5 |
| Smiles: | CC1(C)CC2=C(C(c3cc(c(c(c3)OC)O)OC)Nc3c(N2)non3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3909 |
| logD: | 0.3243 |
| logSw: | -2.6317 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.258 |
| InChI Key: | VXNSQBKIFLWZNY-HNNXBMFYSA-N |