4-(4-bromophenyl)-6-chloro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(4-bromophenyl)-6-chloro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(4-bromophenyl)-6-chloro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0505 |
| Compound Name: | 4-(4-bromophenyl)-6-chloro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 467.77 |
| Molecular Formula: | C19 H16 Br Cl N2 O3 S |
| Smiles: | C1CCN(C1)C(C1=CN(c2ccc(cc2)[Br])c2cc(ccc2S1(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7067 |
| logD: | 3.7067 |
| logSw: | -4.0802 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.965 |
| InChI Key: | IHZQSIKSDONCCG-UHFFFAOYSA-N |