AC1N4XTI
6-[[4-(4-chlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
Also Known As: F0648-0800|6-((5-(allylthio)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl)methyl)pyrimidine-2,4(1H,3H)-dione|6-[[4-(4-chlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione|6-{[4-(4-chlorophenyl)-5-(prop-2-en-1-ylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C16H14ClN5O2S |
|---|---|
| Molecular Weight | 375.05566 g/mol |
| LogP | 2.1662 |
| Topological Polar Surface Area | 96.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.05566 |
| Monoisotopic Mass | 375.05566 |
| Heavy Atoms | 25 |
| Complexity | 978.1048 |
Chemical Identifiers
| CAS Number | 852154-64-4 |
|---|---|
| SMILES | C=CCSC1=NN=C(N1C2=CC=C(C=C2)Cl)CC3=CC(=O)NC(=O)N3 |
Product Overview
AC1N4XTI (CAS 852154-64-4), with molecular formula C16H14ClN5O2S and molecular weight 375.05566 g/mol. IUPAC: 6-[[4-(4-chlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione.
AC1N4XTI is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »