AC1L766W
ethyl 2-[8-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]octylamino]-6-oxo-1H-pyrimidine-5-carboxylate
Also Known As: Diethyl 2,2'-(octane-1,8-diylbis(azanediyl))bis(6-oxo-1,6-dihydropyrimidine-5-carboxylate)|ethyl 2-[8-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]|ethyl2-[8-[ amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate|ETHYL 2-[8-[(5-ETHOXYCARBONYL-4-OXO-3H-PYRIMIDIN-2-YL)AMINO]OCTYLAMINO]-4-OXO-3H-PYRIMIDINE-5-CARBOXYLATE|ethyl 2-[8-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]octylamino]-6-oxo-1H-pyrimidine-5-carboxylate|Diethyl 2,2'-(octane-1,8-diyldiazanediyl)bis(6-oxo-1,6-dihydropyrimidine-5-carboxylate)|Diethyl 2,2'-[octane-1,8-diylbis(azanediyl)]bis(6-oxo-1,6-dihydropyrimidine-5-carboxylate)
| Molecular Formula | C22H32N6O6 |
|---|---|
| Molecular Weight | 476.23834 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 476.23834 |
| Monoisotopic Mass | 476.23834 |
| Heavy Atoms | 34 |
| Complexity | 820.0 |
Chemical Identifiers
| CAS Number | 92736-12-4 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(NC1=O)NCCCCCCCCNC2=NC=C(C(=O)N2)C(=O)OCC |
| InChIKey | LCRRLBLWHVDMPB-UHFFFAOYSA-N |
Product Overview
AC1L766W (CAS 92736-12-4), with molecular formula C22H32N6O6 and molecular weight 476.23834 g/mol. IUPAC: ethyl 2-[8-[(5-ethoxycarbonyl-6-oxo-1H-pyrimidin-2-yl)amino]octylamino]-6-oxo-1H-pyrimidine-5-carboxylate.
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