6-chloro-1,1-dioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
6-chloro-1,1-dioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
6-chloro-1,1-dioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0318 |
| Compound Name: | 6-chloro-1,1-dioxo-4-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 406.84 |
| Molecular Formula: | C18 H15 Cl N2 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)N1C=C(C#N)S(c2ccc(cc12)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4151 |
| logD: | 2.4151 |
| logSw: | -3.0728 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.985 |
| InChI Key: | NAENPYNCPZLOQE-UHFFFAOYSA-N |