4,5-dimethoxy-2-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoic acid
Chemical Structure Depiction of
4,5-dimethoxy-2-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoic acid
4,5-dimethoxy-2-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoic acid
Compound characteristics
| Compound ID: | C648-0222 |
| Compound Name: | 4,5-dimethoxy-2-{[1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carbonyl]amino}benzoic acid |
| Molecular Weight: | 519.53 |
| Molecular Formula: | C23 H25 N3 O9 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCCC(C1)C(Nc1cc(c(cc1C(O)=O)OC)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4389 |
| logD: | -1.6284 |
| logSw: | -2.5247 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.811 |
| InChI Key: | AAWMTSZVDHHHKS-ZDUSSCGKSA-N |