TL;DR: N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide (CAS 511282-22-7) is a chemical compound with molecular formula C12H10N4OS2 and molecular weight 290.0296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Also Known As: CBKinase1_006409, CBKinase1_018809, BRD-K90376217-001-01-7, N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide, N-(4-cyanophenyl)-2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)acetamide
| Molecular Formula | C12H10N4OS2 |
| Molecular Weight | 290.0296 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.0296 Da |
| Heavy Atoms | 19 |
| Complexity | 362.0 |
| SMILES | CC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C#N |
| InChIKey | WWVWDBVULHGAPJ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide. Following Lipinski's Rule of Five, N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is 511282-22-7.
The molecular formula of N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is C12H10N4OS2.
The molecular weight of N-(4-cyanophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is 290.0296 g/mol.
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