TL;DR: (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide (CAS 135810-36-5) is a chemical compound with molecular formula C13H9Cl2N3 and molecular weight 277.01736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-[(2,6-dichlorophenyl)methyl]-2-pyridinylidene]cyanamide
Also Known As: (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide, Cyanamide, (1-(2,6-dichlorophenyl)-2(1H)-pyridinylidene)-, N-Cyano-1-(2,6-dichlorobenzyl)pyridin-2(1H)-imine, [1-[(2,6-dichlorophenyl)methyl]pyridin-2-ylidene]cyanamide, ({1-[(2,6-dichlorophenyl)methyl]-1,2-dihydropyridin-2-ylidene}amino)formonitrile
| Molecular Formula | C13H9Cl2N3 |
| Molecular Weight | 277.01736 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.01736 Da |
| Heavy Atoms | 18 |
| Complexity | 423.0 |
| SMILES | C1=CC(=NC#N)N(C=C1)CC2=C(C=CC=C2Cl)Cl |
| InChIKey | HJSRHJLZFYUICE-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide is 135810-36-5.
The molecular formula of (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide is C13H9Cl2N3.
The molecular weight of (1-(2,6-Dichlorophenyl)-2(1H)-pyridinylidene)cyanamide is 277.01736 g/mol.
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