N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F536-0036 |
| Compound Name: | N-{2-[4-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C20 H22 N4 O6 S2 |
| Smiles: | Cc1cc2c(cc1S(N1CCN(CC1)C(CNC(c1cccs1)=O)=O)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5326 |
| logD: | 0.5321 |
| logSw: | -2.4621 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.852 |
| InChI Key: | HLQYFQAHVYXXOI-UHFFFAOYSA-N |