methyl 4-({5-[2-(4-acetamido-3-methyl-1,2-oxazol-5-yl)ethenyl]-2-methoxybenzene-1-sulfonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({5-[2-(4-acetamido-3-methyl-1,2-oxazol-5-yl)ethenyl]-2-methoxybenzene-1-sulfonyl}amino)benzoate
methyl 4-({5-[2-(4-acetamido-3-methyl-1,2-oxazol-5-yl)ethenyl]-2-methoxybenzene-1-sulfonyl}amino)benzoate
Compound characteristics
| Compound ID: | L991-0841 |
| Compound Name: | methyl 4-({5-[2-(4-acetamido-3-methyl-1,2-oxazol-5-yl)ethenyl]-2-methoxybenzene-1-sulfonyl}amino)benzoate |
| Molecular Weight: | 485.51 |
| Molecular Formula: | C23 H23 N3 O7 S |
| Smiles: | CC(Nc1c(C)noc1/C=C\c1ccc(c(c1)S(Nc1ccc(cc1)C(=O)OC)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.413 |
| logD: | 1.9497 |
| logSw: | -3.0226 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.074 |
| InChI Key: | QWUYNBYCUVFNLX-UHFFFAOYSA-N |