2-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
2-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | G008-1947 |
| Compound Name: | 2-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C21 H22 N2 O3 S |
| Smiles: | Cc1ccc(cc1S(N1CCc2ccccc2C1)(=O)=O)c1c(C)c(C)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.6957 |
| logD: | 4.6957 |
| logSw: | -4.3561 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.956 |
| InChI Key: | BETGJLGORKPTDL-UHFFFAOYSA-N |