TL;DR: 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride (CAS 1049794-73-1) is a chemical compound with molecular formula C7H6Cl3N3 and molecular weight 236.96272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dichloro-4-hydrazinylbenzonitrile;hydrochloride
Also Known As: 3,5-dichloro-4-hydrazinylbenzonitrile hydrochloride, 3,5-dichloro-4-hydrazinyl-benzonitrile Hydrochloride
| Molecular Formula | C7H6Cl3N3 |
| Molecular Weight | 236.96272 g/mol |
| XLogP | 2.57248 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.96272 Da |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
| SMILES | C1=C(C=C(C(=C1Cl)NN)Cl)C#N.Cl |
| InChIKey | JACGGTGEDZSLDY-UHFFFAOYSA-N |
The XLogP value of 2.57248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride. Following Lipinski's Rule of Five, 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride is 1049794-73-1.
The molecular formula of 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride is C7H6Cl3N3.
The molecular weight of 3,5-Dichloro-4-hydrazinylbenzonitrile hydrochloride is 236.96272 g/mol.
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