N-(2-{butyl[(thiophen-2-yl)methyl]amino}ethyl)-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
N-(2-{butyl[(thiophen-2-yl)methyl]amino}ethyl)-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
N-(2-{butyl[(thiophen-2-yl)methyl]amino}ethyl)-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | G805-0557 |
| Compound Name: | N-(2-{butyl[(thiophen-2-yl)methyl]amino}ethyl)-6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 437.58 |
| Molecular Formula: | C20 H27 N3 O4 S2 |
| Smiles: | CCCCN(CCNS(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)Cc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.1051 |
| logD: | 2.993 |
| logSw: | -3.2139 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.067 |
| InChI Key: | CTEAIAYZDNQFHT-UHFFFAOYSA-N |