N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | K906-6530 |
| Compound Name: | N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-N,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 507.01 |
| Molecular Formula: | C23 H27 Cl N4 O5 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CN(C)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5265 |
| logD: | 2.5259 |
| logSw: | -3.4137 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.425 |
| InChI Key: | FJLKFMSXDVSTHT-UHFFFAOYSA-N |