TL;DR: N-Phenyl-benzamidine perchlorate (CAS 163685-94-7) is a chemical compound with molecular formula C13H13ClN2O4 and molecular weight 296.0564 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
perchloric acid;N'-phenylbenzenecarboximidamide
Also Known As: N-PHENYL-BENZAMIDINE PERCHLORATE, (E)-N'-phenylbenzimidamide perchlorate, N-phenylbenzenecarboximidamide; perchloric acid, perchloric acid;N'-phenylbenzenecarboximidamide, N'-Phenylbenzenecarboximidamide perchlorate
| Molecular Formula | C13H13ClN2O4 |
| Molecular Weight | 296.0564 g/mol |
| XLogP | -1.4004 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.0564 Da |
| Heavy Atoms | 20 |
| Complexity | 325.0 |
| SMILES | C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N.OCl(=O)(=O)=O |
| InChIKey | IVELQUKBYQYTED-UHFFFAOYSA-N |
The XLogP value of -1.4004 indicates that N-Phenyl-benzamidine perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Phenyl-benzamidine perchlorate. Following Lipinski's Rule of Five, N-Phenyl-benzamidine perchlorate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Phenyl-benzamidine perchlorate is 163685-94-7.
The molecular formula of N-Phenyl-benzamidine perchlorate is C13H13ClN2O4.
The molecular weight of N-Phenyl-benzamidine perchlorate is 296.0564 g/mol.
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