AC1MSJKA
2-N-[(4-chlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
Also Known As: [4-amino-6-(4-methylpiperazinyl)-5-nitropyrimidin-2-yl][(4-chlorophenyl)methyl ]amine|2-N-[(4-chlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine|N-[(4-chlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidine-2,4-diamine|N~2~-(4-chlorobenzyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine|N2-(4-chlorobenzyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine|N2-[(4-chlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
| Molecular Formula | C16H20ClN7O2 |
|---|---|
| Molecular Weight | 377.1367 g/mol |
| LogP | 1.9843 |
| Topological Polar Surface Area | 113.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.1367 |
| Monoisotopic Mass | 377.1367 |
| Heavy Atoms | 26 |
| Complexity | 791.9304 |
Chemical Identifiers
| CAS Number | 673441-33-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=C(C=C3)Cl |
Product Overview
AC1MSJKA (CAS 673441-33-3), with molecular formula C16H20ClN7O2 and molecular weight 377.1367 g/mol. IUPAC: 2-N-[(4-chlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine.
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