6-(3,5-dimethylpiperidine-1-sulfonyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(3,5-dimethylpiperidine-1-sulfonyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
6-(3,5-dimethylpiperidine-1-sulfonyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-1150 |
| Compound Name: | 6-(3,5-dimethylpiperidine-1-sulfonyl)-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 526.65 |
| Molecular Formula: | C27 H34 N4 O5 S |
| Smiles: | CC1CC(C)CN(C1)S(c1ccc2c(c1)N(CC(N1CCN(CC1)c1ccccc1)=O)C(CO2)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0976 |
| logD: | 3.0975 |
| logSw: | -3.5676 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.299 |
| InChI Key: | VMNADRASGOOSTG-UHFFFAOYSA-N |