1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propan-1-one
Compound characteristics
| Compound ID: | F382-1639 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]propan-1-one |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C24 H26 N2 O4 S |
| Smiles: | Cc1ccc(cc1S(CCC(N1CCc2ccccc2C1)=O)(=O)=O)c1c(C)c(C)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.051 |
| logD: | 4.051 |
| logSw: | -4.0724 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.403 |
| InChI Key: | OVBVDNMWSSXDQI-UHFFFAOYSA-N |