methyl 4-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methoxyphenyl)glycyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methoxyphenyl)glycyl]amino}benzoate
methyl 4-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methoxyphenyl)glycyl]amino}benzoate
Compound characteristics
| Compound ID: | C517-3998 |
| Compound Name: | methyl 4-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methoxyphenyl)glycyl]amino}benzoate |
| Molecular Weight: | 473.5 |
| Molecular Formula: | C22 H23 N3 O7 S |
| Smiles: | Cc1c(c(C)on1)S(N(CC(Nc1ccc(cc1)C(=O)OC)=O)c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8911 |
| logD: | 2.891 |
| logSw: | -3.4694 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.697 |
| InChI Key: | YZRSMIVPQIJTNU-UHFFFAOYSA-N |