4-(3,5-dimethylphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(3,5-dimethylphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(3,5-dimethylphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0360 |
| Compound Name: | 4-(3,5-dimethylphenyl)-6-fluoro-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 400.47 |
| Molecular Formula: | C21 H21 F N2 O3 S |
| Smiles: | Cc1cc(C)cc(c1)N1C=C(C(N2CCCC2)=O)S(c2ccc(cc12)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4734 |
| logD: | 3.4734 |
| logSw: | -3.8985 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.965 |
| InChI Key: | NIRJKYVIUMTASP-UHFFFAOYSA-N |