AC1MWJG9
ethyl 3-methyl-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate
Also Known As: Oprea1_834017|1-Methyl-6-(1-methyl-1H-tetrazol-5-ylsulfanylmethyl)-2-oxo-4-phenyl-1,2,3,4-tetrahydro-pyrimidine-5-car boxylic acid ethyl ester|ethyl 1-methyl-6-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate|ethyl 1-methyl-6-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate|ethyl 3-methyl-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C17H20N6O3S |
|---|---|
| Molecular Weight | 388.13177 g/mol |
| LogP | 1.5157 |
| Topological Polar Surface Area | 102.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.13177 |
| Monoisotopic Mass | 388.13177 |
| Heavy Atoms | 27 |
| Complexity | 866.56354 |
Chemical Identifiers
| CAS Number | 372184-22-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C)CSC3=NN=NN3C |
Product Overview
AC1MWJG9 (CAS 372184-22-0), with molecular formula C17H20N6O3S and molecular weight 388.13177 g/mol. IUPAC: ethyl 3-methyl-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate.