6-chloro-4-(4-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
6-chloro-4-(4-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
6-chloro-4-(4-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0330 |
| Compound Name: | 6-chloro-4-(4-cyanophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 341.77 |
| Molecular Formula: | C16 H8 Cl N3 O2 S |
| Smiles: | C1=C(C#N)S(c2ccc(cc2N1c1ccc(C#N)cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2686 |
| logD: | 2.2686 |
| logSw: | -3.1098 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 65.063 |
| InChI Key: | YHIAXQIOIMLFLA-UHFFFAOYSA-N |