C18H18FN5S2
N-[(E)-(4-fluorophenyl)methylideneamino]-11-methyl-5-methylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: AJ-292/11387649|(E)-4-(2-(4-fluorobenzylidene)hydrazinyl)-7-methyl-2-(methylthio)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine|4-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine|4-fluorobenzaldehyde [7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]hydrazone|N-[(E)-(4-fluorophenyl)methylideneamino]-7-methyl-2-methylsulfanyl-6,8-dihydro-5H-pyrido[4,5]thieno[1,2-c]pyrimidin-4-amine
| Molecular Formula | C18H18FN5S2 |
|---|---|
| Molecular Weight | 387.09875 g/mol |
| LogP | 3.9862 |
| Topological Polar Surface Area | 53.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.09875 |
| Monoisotopic Mass | 387.09875 |
| Heavy Atoms | 26 |
| Complexity | 967.86707 |
Chemical Identifiers
| CAS Number | 330180-18-2 |
|---|---|
| SMILES | CN1CCC2=C(C1)SC3=NC(=NC(=C23)N/N=C/C4=CC=C(C=C4)F)SC |
Product Overview
C18H18FN5S2 (CAS 330180-18-2), with molecular formula C18H18FN5S2 and molecular weight 387.09875 g/mol. IUPAC: N-[(E)-(4-fluorophenyl)methylideneamino]-11-methyl-5-methylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
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