TL;DR: Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)- (CAS 105828-54-4) is a chemical compound with molecular formula C9H12N4O2 and molecular weight 208.09602 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-2-(nitromethylidene)-1-(1H-pyrrol-2-ylmethyl)imidazolidine
Also Known As: Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)-, (2Z)-2-(nitromethylidene)-1-(1H-pyrrol-2-ylmethyl)imidazolidine
| Molecular Formula | C9H12N4O2 |
| Molecular Weight | 208.09602 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 76.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.09602 Da |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
| SMILES | C1CN(/C(=C\[N+](=O)[O-])/N1)CC2=CC=CN2 |
| InChIKey | WGAIOXKWUFBTLX-CLFYSBASSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)-. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)-. Following Lipinski's Rule of Five, Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)- is 105828-54-4.
The molecular formula of Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)- is C9H12N4O2.
The molecular weight of Imidazolidine, 2-(nitromethylene)-1-(1H-pyrrol-2-ylmethyl)- is 208.09602 g/mol.
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