3-(3,5-dimethyl-1H-pyrazole-1-carbonyl)-2-methyl-4-phenyl-1lambda~6~,2-benzothiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazole-1-carbonyl)-2-methyl-4-phenyl-1lambda~6~,2-benzothiazine-1,1(2H)-dione
3-(3,5-dimethyl-1H-pyrazole-1-carbonyl)-2-methyl-4-phenyl-1lambda~6~,2-benzothiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | C200-6182 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazole-1-carbonyl)-2-methyl-4-phenyl-1lambda~6~,2-benzothiazine-1,1(2H)-dione |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | Cc1cc(C)n(C(C2=C(c3ccccc3)c3ccccc3S(N2C)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2901 |
| logD: | 3.2901 |
| logSw: | -3.7207 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.745 |
| InChI Key: | JIBNVJPUFCFXBU-UHFFFAOYSA-N |