6-chloro-N-methyl-3-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
6-chloro-N-methyl-3-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
6-chloro-N-methyl-3-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | K906-3937 |
| Compound Name: | 6-chloro-N-methyl-3-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C21 H23 Cl N4 O5 S |
| Smiles: | CN(CC(N1CCN(CC1)c1ccccc1)=O)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5033 |
| logD: | 1.4447 |
| logSw: | -2.8456 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.726 |
| InChI Key: | DJMHCPYCZYZUJP-UHFFFAOYSA-N |