| CAS Number | 790232-14-3 |
| Catalog Number | AG019JNS |
| Chemical Name | 6-Amino-1-(2-methoxyethyl)-5-(piperidin-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione |
| IUPAC Name | 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione |
| InChI | InChI=1S/C12H20N4O3/c1-19-8-7-16-10(13)9(11(17)14-12(16)18)15-5-3-2-4-6-15/h2-8,13H2,1H3,(H,14,17,18) |
| InChI Key | WQDMJJWAWFCGHB-UHFFFAOYSA-N |
| MDL Number | MFCD06356459 |
| Molecular Formula | C12H20N4O3 |
| Molecular Weight | 268.3122 |
| SMILES | COCCN1C(=O)NC(=O)C(N2CCCCC2)=C1N |
| Synonyms | 6-amino-1-(2-methoxyethyl)-5-(piperidin-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione,
790232-14-3,
6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4(1H,3H)-dione,
AC1Q4FWH,
AC1M8Z7N,
CTK7B3228,
ZINC3379293,
NE36156,
EN300-09930,
6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione,
ZINC03379293,
CID2497425,
|
| Complexity | 402 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.154g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.317g/mol |
| Monoisotopic Mass | 268.154g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 87.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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Certificate of Analysis
Lot Number