methyl 4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
methyl 4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Compound characteristics
Compound ID: | L464-0612 |
Compound Name: | methyl 4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]amino}benzoate |
Molecular Weight: | 392.45 |
Molecular Formula: | C17 H16 N2 O5 S2 |
Smiles: | Cc1c(C)noc1c1ccc(s1)S(Nc1ccc(cc1)C(=O)OC)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1633 |
logD: | 3.9581 |
logSw: | -4.2214 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.425 |
InChI Key: | YTUXSZKDMCRHIY-UHFFFAOYSA-N |