2-cyano-N~1~-(5-morpholino-1,3,4-thiadiazol-2-yl)-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-morpholino-1,3,4-thiadiazol-2-yl)-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
2-cyano-N~1~-(5-morpholino-1,3,4-thiadiazol-2-yl)-3-[5-(4-nitrophenyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C726-1758 |
| Compound Name: | 2-cyano-N~1~-(5-morpholino-1,3,4-thiadiazol-2-yl)-3-[5-(4-nitrophenyl)-2-furyl]acrylamide |
| Molecular Weight: | 452.45 |
| Molecular Formula: | C20 H16 N6 O5 S |
| Smiles: | C1COCCN1c1nnc(NC(C(=C/c2ccc(c3ccc(cc3)[N+]([O-])=O)o2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.78 |
| logD: | 3.62 |
| logSw: | -4.86 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 251.75 |
| InChI Key: | KKQRFTOKYATKOK-UHFFFAOYSA-N |