alpha',2'-Benzobenzamil
TL;DR: alpha',2'-Benzobenzamil (CAS 133906-28-2) is a chemical compound with molecular formula C16H13ClN6O and molecular weight 340.08392 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-diamino-N-[amino(naphthalen-1-yl)methylidene]-6-chloropyrazine-2-carboxamide
Also Known As: ATBB, alpha',2'-Benzobenzamil, alpha/',2/'-Benzobenzamil, 3,5-diamino-N-[amino(naphthalen-1-yl)methylidene]-6-chloropyrazine-2-carboxamide, 3,5-Diamino-6-chloro-N-(imino-1-naphthalenylmethyl)pyrazinecarboxamide
Technical Specifications
| Molecular Formula | C16H13ClN6O |
| Molecular Weight | 340.08392 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.08392 Da |
| Heavy Atoms | 24 |
| Complexity | 501.0 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2C(=NC(=O)C3=C(N=C(C(=N3)Cl)N)N)N |
| InChIKey | SHADDSMXSDFEBS-UHFFFAOYSA-N |
Chemical Property Profile of alpha',2'-Benzobenzamil
Property Insights of alpha',2'-Benzobenzamil
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha',2'-Benzobenzamil. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha',2'-Benzobenzamil. Following Lipinski's Rule of Five, alpha',2'-Benzobenzamil has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of alpha',2'-Benzobenzamil?
The CAS number of alpha',2'-Benzobenzamil is 133906-28-2.
What is the molecular formula of alpha',2'-Benzobenzamil?
The molecular formula of alpha',2'-Benzobenzamil is C16H13ClN6O.
What is the molecular weight of alpha',2'-Benzobenzamil?
The molecular weight of alpha',2'-Benzobenzamil is 340.08392 g/mol.
Where can I buy alpha',2'-Benzobenzamil?
You can request a quote for alpha',2'-Benzobenzamil directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha',2'-Benzobenzamil?
Yes, CoreyChem provides custom synthesis services for alpha',2'-Benzobenzamil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.