2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[4-(1-phenylethoxy)phenyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[4-(1-phenylethoxy)phenyl]acrylamide
2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[4-(1-phenylethoxy)phenyl]acrylamide
Compound characteristics
| Compound ID: | 3773-2706 |
| Compound Name: | 2-cyano-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[4-(1-phenylethoxy)phenyl]acrylamide |
| Molecular Weight: | 418.52 |
| Molecular Formula: | C23 H22 N4 O2 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2ccc(cc2)OC(C)c2ccccc2)\C#N)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.65 |
| logD: | 3.74 |
| logSw: | -6.31 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 145.87 |
| InChI Key: | MRGCNASSOMXPSU-INIZCTEOSA-N |