4-[4-(benzyloxy)phenyl]-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
4-[4-(benzyloxy)phenyl]-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
4-[4-(benzyloxy)phenyl]-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0028 |
| Compound Name: | 4-[4-(benzyloxy)phenyl]-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C22 H16 N2 O3 S |
| Smiles: | C(c1ccccc1)Oc1ccc(cc1)N1C=C(C#N)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2868 |
| logD: | 3.2868 |
| logSw: | -3.5834 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.234 |
| InChI Key: | DKWWEWDEMPDOOS-UHFFFAOYSA-N |