AC1MDHK3
pentyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00135169|AG-690/33461034|pentyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|pentyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate|pentyl 4-(4-(diethylamino)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|pentyl 6-[4-(diethylamino)phenyl]-4-methyl-2-thioxo-1,3,6-trihydropyrimidine-5 -carboxylate
| Molecular Formula | C21H31N3O2S |
|---|---|
| Molecular Weight | 389.21368 g/mol |
| LogP | 4.059 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 389.21368 |
| Monoisotopic Mass | 389.21368 |
| Heavy Atoms | 27 |
| Complexity | 681.17206 |
Chemical Identifiers
| CAS Number | 296262-60-7 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)N(CC)CC)C |
Product Overview
AC1MDHK3 (CAS 296262-60-7), with molecular formula C21H31N3O2S and molecular weight 389.21368 g/mol. IUPAC: pentyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
AC1MDHK3 is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »