4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-dimethyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-dimethyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-dimethyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | G660-0004 |
| Compound Name: | 4-[2-(azepan-1-yl)-2-oxoethyl]-N,N-dimethyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C18 H27 N3 O3 S2 |
| Smiles: | CN(C)S(c1ccc2c(c1)N(CCS2)CC(N1CCCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6283 |
| logD: | 2.6283 |
| logSw: | -3.1127 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.188 |
| InChI Key: | IUWPTRWVTZDSIV-UHFFFAOYSA-N |