6-chloro-1,1-dioxo-4-[3-(propan-2-yl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
6-chloro-1,1-dioxo-4-[3-(propan-2-yl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
6-chloro-1,1-dioxo-4-[3-(propan-2-yl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0307 |
| Compound Name: | 6-chloro-1,1-dioxo-4-[3-(propan-2-yl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 358.84 |
| Molecular Formula: | C18 H15 Cl N2 O2 S |
| Smiles: | CC(C)c1cccc(c1)N1C=C(C#N)S(c2ccc(cc12)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8979 |
| logD: | 3.8979 |
| logSw: | -4.3165 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.007 |
| InChI Key: | MKUVURQAYARGNN-UHFFFAOYSA-N |