N-[(3-bromophenyl)methyl]-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
N-[(3-bromophenyl)methyl]-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Compound characteristics
| Compound ID: | G729-1140 |
| Compound Name: | N-[(3-bromophenyl)methyl]-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 478.36 |
| Molecular Formula: | C20 H20 Br N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(NCc2cccc(c2)[Br])=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2602 |
| logD: | 3.2602 |
| logSw: | -3.5321 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.808 |
| InChI Key: | YBMXYUIHEAOESU-UHFFFAOYSA-N |