6-(4-benzylpiperidin-1-yl)-N~2~-(4-chlorobenzyl)-5-nitropyrimidine-2,4-diamine
6-(4-benzylpiperidin-1-yl)-2-N-[(4-chlorophenyl)methyl]-5-nitropyrimidine-2,4-diamine
Also Known As: {4-amino-5-nitro-6-[4-benzylpiperidyl]pyrimidin-2-yl}[(4-chlorophenyl)methyl]a mine|6-(4-benzyl-1-piperidyl)-N-[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-2,4-diamine|6-(4-benzylpiperidin-1-yl)-2-N-[(4-chlorophenyl)methyl]-5-nitropyrimidine-2,4-diamine|6-(4-benzylpiperidin-1-yl)-N~2~-(4-chlorobenzyl)-5-nitropyrimidine-2,4-diamine|6-(4-benzylpiperidin-1-yl)-N2-(4-chlorobenzyl)-5-nitropyrimidine-2,4-diamine|6-(4-BENZYLPIPERIDIN-1-YL)-N2-[(4-CHLOROPHENYL)METHYL]-5-NITROPYRIMIDINE-2,4-DIAMINE
| Molecular Formula | C23H25ClN6O2 |
|---|---|
| Molecular Weight | 452.17276 g/mol |
| LogP | 4.6916 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.17276 |
| Monoisotopic Mass | 452.17276 |
| Heavy Atoms | 32 |
| Complexity | 1069.8496 |
Chemical Identifiers
| CAS Number | 674357-13-2 |
|---|---|
| SMILES | C1CN(CCC1CC2=CC=CC=C2)C3=NC(=NC(=C3[N+](=O)[O-])N)NCC4=CC=C(C=C4)Cl |
Product Overview
6-(4-benzylpiperidin-1-yl)-N~2~-(4-chlorobenzyl)-5-nitropyrimidine-2,4-diamine (CAS 674357-13-2), with molecular formula C23H25ClN6O2 and molecular weight 452.17276 g/mol. IUPAC: 6-(4-benzylpiperidin-1-yl)-2-N-[(4-chlorophenyl)methyl]-5-nitropyrimidine-2,4-diamine.