AC1NDKHH
methyl 6-(3-methoxy-4-phenylmethoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
Also Known As: Oprea1_481711|AF-399/40828067|SR-01000444592-1|F0497-0194|methyl 6-(3-methoxy-4-phenylmethoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate|methyl 4-(4-(benzyloxy)-3-methoxyphenyl)-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|methyl 4-[4-(benzyloxy)-3-methoxyphenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate|methyl 4-[4-(benzyloxy)-3-methoxyphenyl]-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
| Molecular Formula | C22H24N2O4S |
|---|---|
| Molecular Weight | 412.1457 g/mol |
| LogP | 3.5822 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.1457 |
| Monoisotopic Mass | 412.1457 |
| Heavy Atoms | 29 |
| Complexity | 943.0834 |
Chemical Identifiers
| CAS Number | 367907-63-9 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1C)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)OC |
Product Overview
AC1NDKHH (CAS 367907-63-9), with molecular formula C22H24N2O4S and molecular weight 412.1457 g/mol. IUPAC: methyl 6-(3-methoxy-4-phenylmethoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate.
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