N~1~-[3-(benzylsulfonyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acrylamide
Chemical Structure Depiction of
N~1~-[3-(benzylsulfonyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acrylamide
N~1~-[3-(benzylsulfonyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C355-1565 |
| Compound Name: | N~1~-[3-(benzylsulfonyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acrylamide |
| Molecular Weight: | 521.53 |
| Molecular Formula: | C23 H15 N5 O6 S2 |
| Smiles: | C(c1ccccc1)S(c1nc(NC(C(=C/c2ccc(c3cccc(c3)[N+]([O-])=O)o2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.57 |
| logD: | 2.22 |
| logSw: | -5.18 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 280.12 |
| InChI Key: | MKBHBNZKQYZPII-UHFFFAOYSA-N |