AC1N3HE0
(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone
Also Known As: F6548-4750|4-({[4-(4-phenyl-1,2,3,6-tetrahydropyridine-1-carbonyl)cyclohexyl]methyl}amino)-1,2-dihydroquinazoline-2-thione|(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone|(4-phenyl-5,6-dihydropyridin-1(2H)-yl)(4-(((2-thioxo-1,2-dihydroquinazolin-4-yl)amino)methyl)cyclohexyl)methanone
| Molecular Formula | C27H30N4OS |
|---|---|
| Molecular Weight | 458.21402 g/mol |
| LogP | 5.82659 |
| Topological Polar Surface Area | 61.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.21402 |
| Monoisotopic Mass | 458.21402 |
| Heavy Atoms | 33 |
| Complexity | 1211.5234 |
Chemical Identifiers
| CAS Number | 689265-89-2 |
|---|---|
| SMILES | C1CC(CCC1CNC2=NC(=S)NC3=CC=CC=C32)C(=O)N4CCC(=CC4)C5=CC=CC=C5 |
Product Overview
AC1N3HE0 (CAS 689265-89-2), with molecular formula C27H30N4OS and molecular weight 458.21402 g/mol. IUPAC: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone.
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