AC1MF1XS
ethyl 4-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: SR-01000491492-1|ethyl 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|5-Pyrimidinecarboxylic acid, 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,2,3,4-tetrahydro-6-methyl-2-thioxo-, ethyl ester|ethyl 4-(3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|ETHYL 4-[3-(4-BROMOPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-6-METHYL-2-SULFANYLIDENE-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE|ethyl 4-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate|ethyl 4-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate|ethyl 6-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-4-methyl-2-thioxo-1,3,6-trihy dropyrimidine-5-carboxylate
| Molecular Formula | C23H21BrN4O2S |
|---|---|
| Molecular Weight | 496.05685 g/mol |
| LogP | 4.6577 |
| Topological Polar Surface Area | 68.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.05685 |
| Monoisotopic Mass | 496.05685 |
| Heavy Atoms | 31 |
| Complexity | 1156.0793 |
Chemical Identifiers
| CAS Number | 432015-06-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4)C |
Product Overview
AC1MF1XS (CAS 432015-06-0), with molecular formula C23H21BrN4O2S and molecular weight 496.05685 g/mol. IUPAC: ethyl 4-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
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