2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C356-0074 |
| Compound Name: | 2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-[5-(4-nitrophenyl)-2-furyl]acrylamide |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C17 H11 N5 O6 S2 |
| Smiles: | CS(c1nnc(NC(C(=C/c2ccc(c3ccc(cc3)[N+]([O-])=O)o2)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.09 |
| logD: | 0.72 |
| logSw: | -4.01 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 303.95 |
| InChI Key: | ZXLQVGHDINSGRC-UHFFFAOYSA-N |