AC1Q4MGN
2-[(4-fluorophenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: UPCMLD0ENAT0513-6666:001|5-{[(4-fluorophenyl)methyl]sulfanyl}-4-phenyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|2-[(4-fluorobenzyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|2-[(4-fluorophenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-[(4-fluorophenyl)methylthio]-3-phenyl-3,5,6,7,8-pentahydrobenzo[b]thiopheno[ 2,3-d]pyrimidin-4-one
| Molecular Formula | C23H19FN2OS2 |
|---|---|
| Molecular Weight | 422.0923 g/mol |
| LogP | 5.7574 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.0923 |
| Monoisotopic Mass | 422.0923 |
| Heavy Atoms | 29 |
| Complexity | 1229.9556 |
Chemical Identifiers
| CAS Number | 433944-55-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC5=CC=C(C=C5)F |
Product Overview
AC1Q4MGN (CAS 433944-55-9), with molecular formula C23H19FN2OS2 and molecular weight 422.0923 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
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