4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | G549-0191 |
| Compound Name: | 4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C22 H23 N3 O4 S2 |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)N(CC(N1CCc3ccccc13)=O)C(CS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5847 |
| logD: | 2.5847 |
| logSw: | -3.0335 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.119 |
| InChI Key: | SETQBGAEKMAWME-UHFFFAOYSA-N |