N-(3-cyanophenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
N-(3-cyanophenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
| Compound ID: | L309-0534 |
| Compound Name: | N-(3-cyanophenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
| Molecular Weight: | 439.45 |
| Molecular Formula: | C20 H17 N5 O5 S |
| Smiles: | CCc1nc(CN2C(COc3ccc(cc23)S(Nc2cccc(C#N)c2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.4521 |
| logD: | 2.314 |
| logSw: | -3.0399 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.379 |
| InChI Key: | OMERHZPEZLITDM-UHFFFAOYSA-N |