4-[4-(dimethylamino)phenyl]-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-[4-(dimethylamino)phenyl]-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-[4-(dimethylamino)phenyl]-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0021 |
| Compound Name: | 4-[4-(dimethylamino)phenyl]-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | CN(C)c1ccc(cc1)N1C=C(C(N2CCCC2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2212 |
| logD: | 2.2205 |
| logSw: | -2.5489 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.77 |
| InChI Key: | HPBXDEXHUCYTBF-UHFFFAOYSA-N |