ethyl 4-{[2,5-dimethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-pyrrole-3-sulfonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[2,5-dimethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-pyrrole-3-sulfonyl]amino}benzoate
ethyl 4-{[2,5-dimethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-pyrrole-3-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | M954-0068 |
| Compound Name: | ethyl 4-{[2,5-dimethyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-pyrrole-3-sulfonyl]amino}benzoate |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C18 H20 N4 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NS(c1c(c(C)[nH]c1C)c1nc(C)no1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9265 |
| logD: | 2.586 |
| logSw: | -3.3451 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.72 |
| InChI Key: | DKYJRJVRBWCRHR-UHFFFAOYSA-N |