N-benzyl-4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-benzyl-4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N-methylbenzene-1-sulfonamide
N-benzyl-4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D434-1002 |
| Compound Name: | N-benzyl-4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 484.58 |
| Molecular Formula: | C27 H24 N4 O3 S |
| Smiles: | CN(Cc1ccccc1)S(c1ccc(cc1)c1nc(C#N)c(N2CCc3ccccc3C2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0048 |
| logD: | 5.0048 |
| logSw: | -4.6378 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.981 |
| InChI Key: | PSJIUZBWARWDKE-UHFFFAOYSA-N |