AC1MH696
N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide
Also Known As: N-(4-methoxyphenyl)-2-((5-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)-1,3,4-thiadiazol-2-yl)thio)acetamide|N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide|N-[(2E)-5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-oxoquinazolin-3(4H)-yl)acetamide|N-[5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-(4-oxoquinazolin-3(4H)-yl)acetamide
| Molecular Formula | C21H18N6O4S2 |
|---|---|
| Molecular Weight | 482.0831 g/mol |
| LogP | 2.6261 |
| Topological Polar Surface Area | 128.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.0831 |
| Monoisotopic Mass | 482.0831 |
| Heavy Atoms | 33 |
| Complexity | 1352.8862 |
Chemical Identifiers
| CAS Number | 830352-55-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)CN3C=NC4=CC=CC=C4C3=O |
Product Overview
AC1MH696 (CAS 830352-55-1), with molecular formula C21H18N6O4S2 and molecular weight 482.0831 g/mol. IUPAC: N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide.
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