4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
Chemical Structure Depiction of
4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | C079-0111 |
| Compound Name: | 4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide |
| Molecular Weight: | 490.54 |
| Molecular Formula: | C25 H22 N4 O5 S |
| Smiles: | COc1cccc(c1)c1nnc(NC(c2ccc(cc2)S(N2CCc3ccccc3C2)(=O)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.6102 |
| logD: | 3.5243 |
| logSw: | -3.9049 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.075 |
| InChI Key: | HCTQWTFCSUXNRN-UHFFFAOYSA-N |