N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
Chemical Structure Depiction of
N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
Compound characteristics
| Compound ID: | M018-0085 |
| Compound Name: | N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CC(Nc1c(c2ccc(C)c(c2)S(N2CCc3ccccc3C2)(=O)=O)c(C)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.267 |
| logD: | 3.245 |
| logSw: | -3.5147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.266 |
| InChI Key: | QQZAIOMISORVJZ-UHFFFAOYSA-N |