4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
| Compound ID: | L309-0701 |
| Compound Name: | 4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[2-(3-methylthiophen-2-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C20 H22 N4 O5 S2 |
| Smiles: | CCc1nc(CN2C(COc3ccc(cc23)S(NCCc2c(C)ccs2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.1408 |
| logD: | 3.1408 |
| logSw: | -3.4669 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.291 |
| InChI Key: | UMEMMEXIEPVFLY-UHFFFAOYSA-N |