methyl 3-{[5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]amino}benzoate
methyl 3-{[5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]amino}benzoate
Compound characteristics
Compound ID: | P657-0657 |
Compound Name: | methyl 3-{[5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]amino}benzoate |
Molecular Weight: | 389.38 |
Molecular Formula: | C17 H15 N3 O6 S |
Smiles: | COC(c1cccc(c1)NS(c1ccc(c2nnc(C3CC3)o2)o1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3775 |
logD: | 3.3097 |
logSw: | -3.7612 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 101.721 |
InChI Key: | XTPOODCTRYVPJL-UHFFFAOYSA-N |