N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y207-3506 |
| Compound Name: | N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C20 H19 N3 O4 S |
| Smiles: | Cc1cc(C(Nc2ccc(cc2)S(N2CCc3ccccc3C2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.543 |
| logD: | 3.5409 |
| logSw: | -3.8623 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.931 |
| InChI Key: | OYJPSVSSBXVVDF-UHFFFAOYSA-N |