TL;DR: 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine (CAS 133116-04-8) is a chemical compound with molecular formula C9H10ClN5O2 and molecular weight 255.0523 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-5-[[(2Z)-2-(nitromethylidene)imidazolidin-1-yl]methyl]pyrimidine
Also Known As: 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine, 2-chloro-5-[[(2Z)-2-(nitromethylidene)imidazolidin-1-yl]methyl]pyrimidine
| Molecular Formula | C9H10ClN5O2 |
| Molecular Weight | 255.0523 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.0523 Da |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
| SMILES | C1CN(/C(=C\[N+](=O)[O-])/N1)CC2=CN=C(N=C2)Cl |
| InChIKey | OLNLSIYRYORJQX-VURMDHGXSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine. Following Lipinski's Rule of Five, 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine is 133116-04-8.
The molecular formula of 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine is C9H10ClN5O2.
The molecular weight of 2-chloro-5-(((2Z)-2-(Nitromethylidene)imidazolidin-1-yl)methyl)pyrimidine is 255.0523 g/mol.
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