AC1NDK9Q
N-[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide
Also Known As: Oprea1_766088|F0417-1591|4-ethoxy-N-(5-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide|N-(5-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-ethoxybenzamide|N-[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide
| Molecular Formula | C22H22N4O3S2 |
|---|---|
| Molecular Weight | 454.11334 g/mol |
| LogP | 4.2606 |
| Topological Polar Surface Area | 84.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.11334 |
| Monoisotopic Mass | 454.11334 |
| Heavy Atoms | 31 |
| Complexity | 1068.6278 |
Chemical Identifiers
| CAS Number | 392300-32-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)N3CCCC4=CC=CC=C43 |
Product Overview
AC1NDK9Q (CAS 392300-32-2), with molecular formula C22H22N4O3S2 and molecular weight 454.11334 g/mol. IUPAC: N-[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide.
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