AC1MDHK6
butyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AG-690/33365011|butyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate|butyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|butyl 6-[4-(diethylamino)phenyl]-4-methyl-2-thioxo-1,3,6-trihydropyrimidine-5- carboxylate|butyl 4-(4-(diethylamino)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|butyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C20H29N3O2S |
|---|---|
| Molecular Weight | 375.19806 g/mol |
| LogP | 3.6689 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 375.19806 |
| Monoisotopic Mass | 375.19806 |
| Heavy Atoms | 26 |
| Complexity | 666.1388 |
Chemical Identifiers
| CAS Number | 296262-63-0 |
|---|---|
| SMILES | CCCCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)N(CC)CC)C |
Product Overview
AC1MDHK6 (CAS 296262-63-0), with molecular formula C20H29N3O2S and molecular weight 375.19806 g/mol. IUPAC: butyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
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