AC1LDC4Y
4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide
Also Known As: regid863424|4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide|4-{4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide|N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-(4-(2-(p-tolyloxy)ethyl)piperazin-1-yl)butanamide
| Molecular Formula | C22H31N5O3S |
|---|---|
| Molecular Weight | 445.21475 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 445.21475 |
| Monoisotopic Mass | 445.21475 |
| Heavy Atoms | 31 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 713089-91-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCN2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C(C)C |
| InChIKey | CHSGYPQNQFHYNY-UHFFFAOYSA-N |
Product Overview
AC1LDC4Y (CAS 713089-91-9), with molecular formula C22H31N5O3S and molecular weight 445.21475 g/mol. IUPAC: 4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]-4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide.
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