AC1NRMDH
6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide
Also Known As: DIOX2_006825|6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide|6-Acetamido-N-{[4-(4-[4-(hydroxymethyl)phenyl]-5-methyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-1,3-dioxan-2-yl)phenyl]methyl}hexanamide
| Molecular Formula | C32H40N4O5S |
|---|---|
| Molecular Weight | 592.2719 g/mol |
| LogP | 4.8653 |
| Topological Polar Surface Area | 122.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 592.2719 |
| Monoisotopic Mass | 592.2719 |
| Heavy Atoms | 42 |
| Complexity | 1260.1624 |
Chemical Identifiers
| CAS Number | 6087-20-3 |
|---|---|
| SMILES | CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)CNC(=O)CCCCCNC(=O)C)CSC4=NC=CC=N4 |
Product Overview
AC1NRMDH (CAS 6087-20-3), with molecular formula C32H40N4O5S and molecular weight 592.2719 g/mol. IUPAC: 6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide.
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