AC1LUW4S
5-(3-methylbutylsulfanyl)-4-(4-methylphenyl)-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: Oprea1_518787|2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one|2-(isopentylthio)-7-propyl-3-(p-tolyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one|2-[(3-methylbutyl)sulfanyl]-3-(4-methylphenyl)-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C24H31N3OS2 |
|---|---|
| Molecular Weight | 441.19086 g/mol |
| LogP | 5.66192 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.19086 |
| Monoisotopic Mass | 441.19086 |
| Heavy Atoms | 30 |
| Complexity | 1082.5095 |
Chemical Identifiers
| CAS Number | 375834-71-2 |
|---|---|
| SMILES | CCCN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCCC(C)C)C4=CC=C(C=C4)C |
Product Overview
AC1LUW4S (CAS 375834-71-2), with molecular formula C24H31N3OS2 and molecular weight 441.19086 g/mol. IUPAC: 5-(3-methylbutylsulfanyl)-4-(4-methylphenyl)-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
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