N,N-diethyl-3-oxo-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-3-oxo-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
N,N-diethyl-3-oxo-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
| Compound ID: | C700-0821 |
| Compound Name: | N,N-diethyl-3-oxo-4-(2-oxo-2-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
| Molecular Weight: | 590.7 |
| Molecular Formula: | C28 H38 N4 O8 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)N(CC(N1CCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5942 |
| logD: | 1.3936 |
| logSw: | -2.5809 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 98.162 |
| InChI Key: | FFVAIXMHOFXTQB-UHFFFAOYSA-N |