TL;DR: Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- (CAS 131748-48-6) is a chemical compound with molecular formula C9H12ClN5O2 and molecular weight 257.06796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(6-chloro-3-pyridinyl)methyl]-1,1-dimethyl-3-nitroguanidine
Also Known As: Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro-, 2-[(6-chloropyridin-3-yl)methyl]-1,1-dimethyl-3-nitro-guanidine, 2-[(6-chloropyridin-3-yl)methyl]-1,1-dimethyl-3-nitroguanidine, N''-[(6-CHLOROPYRIDIN-3-YL)METHYL]-N,N-DIMETHYL-N'-NITROGUANIDINE
| Molecular Formula | C9H12ClN5O2 |
| Molecular Weight | 257.06796 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 86.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.06796 Da |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
| SMILES | CN(C)C(=NCC1=CN=C(C=C1)Cl)N[N+](=O)[O-] |
| InChIKey | NRKRPOHWHYCORO-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro-. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro-. Following Lipinski's Rule of Five, Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- has 1 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 Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- is 131748-48-6.
The molecular formula of Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- is C9H12ClN5O2.
The molecular weight of Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- is 257.06796 g/mol.
You can request a quote for Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Guanidine, N'-[(6-chloro-3-pyridinyl)methyl]-N,N-dimethyl-N''-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 131748-48-6. Our professional technical team will respond with pricing and lead time.