4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide
4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D434-0552 |
| Compound Name: | 4-[4-cyano-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CN(C)S(c1ccc(cc1)c1nc(C#N)c(N2CCc3ccccc3C2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4855 |
| logD: | 3.4855 |
| logSw: | -3.7136 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.08 |
| InChI Key: | SBICROTZTXIKDD-UHFFFAOYSA-N |