methyl 4-{4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
Chemical Structure Depiction of
methyl 4-{4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
methyl 4-{4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate
Compound characteristics
| Compound ID: | D321-0208 |
| Compound Name: | methyl 4-{4-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}benzoate |
| Molecular Weight: | 399.83 |
| Molecular Formula: | C20 H18 Cl N3 O4 |
| Smiles: | COC(c1ccc(cc1)NC(CCCc1nc(c2ccccc2[Cl])no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0776 |
| logD: | 4.0775 |
| logSw: | -4.3989 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.633 |
| InChI Key: | CFSSOHYLMNIHSO-UHFFFAOYSA-N |