N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
Chemical Structure Depiction of
N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide
Compound characteristics
| Compound ID: | M018-0721 |
| Compound Name: | N-{4-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]-3-methyl-1,2-oxazol-5-yl}acetamide |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | CC(Nc1c(c2ccc(c(c2)S(N2CCc3ccccc3C2)(=O)=O)OC)c(C)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7263 |
| logD: | 2.7043 |
| logSw: | -3.447 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.896 |
| InChI Key: | SMMOZLWSZOEAMI-UHFFFAOYSA-N |