N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-ethyl-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-ethyl-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-ethyl-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | G938-2444 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-ethyl-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | CCC1C(Nc2cc(C)c(cc2O1)S(N(C)CC(N1CCc2ccccc2C1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7494 |
| logD: | 2.7484 |
| logSw: | -3.3229 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.66 |
| InChI Key: | FBEXLNYSAYRZOL-LJQANCHMSA-N |