AC1MIL6U
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide;hydrochloride
Also Known As: 1-Propanesulfonanilide, 3'-methoxy-4'-(4-(alpha-D-1-O-methyl-glucopyranosid-2-ylcarbamoyl)-9-acridinylamino)-, hydrochloride|Methyl 2-deoxy-2-{9-[2-methoxy-4-(propane-1-sulfonamido)anilino]acridine-4-carboxamido}-alpha-D-glucopyranoside--hydrogen chloride (1/1)|N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide hydrochloride
| Molecular Formula | C31H37ClN4O9S |
|---|---|
| Molecular Weight | 676.19696 g/mol |
| LogP | 2.8975 |
| Topological Polar Surface Area | 188.57 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 676.19696 |
| Monoisotopic Mass | 676.19696 |
| Heavy Atoms | 46 |
| Complexity | 1808.1643 |
Chemical Identifiers
| CAS Number | 63178-57-4 |
|---|---|
| SMILES | CCCS(=O)(=O)NC1=CC(=C(C=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N[C@@H]5[C@H]([C@@H]([C@H](O[C@@H]5OC)CO)O)O)OC.Cl |
Product Overview
AC1MIL6U (CAS 63178-57-4), with molecular formula C31H37ClN4O9S and molecular weight 676.19696 g/mol. IUPAC: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide;hydrochloride.
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