2-[4-(4-nitrophenoxy)benzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[4-(4-nitrophenoxy)benzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
2-[4-(4-nitrophenoxy)benzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 3506-0218 |
| Compound Name: | 2-[4-(4-nitrophenoxy)benzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1ccc(cc1)Oc1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9704 |
| logD: | 4.9704 |
| logSw: | -4.878 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.741 |
| InChI Key: | AJZQJFGZXXOVJL-UHFFFAOYSA-N |