4-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
4-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
4-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
| Compound ID: | K788-9958 |
| Compound Name: | 4-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C26 H34 N4 O5 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)N(CC(N1CCN(CC1)c1cc(C)ccc1C)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1233 |
| logD: | 3.1232 |
| logSw: | -3.2715 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.517 |
| InChI Key: | FATFPFFFKIRUPE-UHFFFAOYSA-N |