methyl 4-{[2-oxo-3-(2-oxo-2-propoxyethyl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[2-oxo-3-(2-oxo-2-propoxyethyl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]amino}benzoate
methyl 4-{[2-oxo-3-(2-oxo-2-propoxyethyl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | F064-1394 |
| Compound Name: | methyl 4-{[2-oxo-3-(2-oxo-2-propoxyethyl)-2,3-dihydro-1,3-benzoxazole-6-sulfonyl]amino}benzoate |
| Molecular Weight: | 448.45 |
| Molecular Formula: | C20 H20 N2 O8 S |
| Smiles: | CCCOC(CN1C(=O)Oc2cc(ccc12)S(Nc1ccc(cc1)C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9286 |
| logD: | 2.8949 |
| logSw: | -3.7002 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.615 |
| InChI Key: | PFUBWZIRNNKRLR-UHFFFAOYSA-N |