4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazine
Chemical Structure Depiction of
4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazine
4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazine
Compound characteristics
Compound ID: | G115-0306 |
Compound Name: | 4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazine |
Molecular Weight: | 400.52 |
Molecular Formula: | C20 H20 N2 O3 S2 |
Smiles: | Cc1ccc(cc1S(N1CCSc2ccccc12)(=O)=O)c1c(C)c(C)no1 |
Stereo: | ACHIRAL |
logP: | 4.3423 |
logD: | 4.3423 |
logSw: | -4.2272 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.736 |
InChI Key: | DGAVNXWQXZQHNX-UHFFFAOYSA-N |