Phenylbiguanide mbt-salt
TL;DR: Phenylbiguanide mbt-salt (CAS 5437-11-6) is a chemical compound with molecular formula C15H16N6S2 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3H-1,3-benzothiazole-2-thione;1-(diaminomethylidene)-2-phenylguanidine
Also Known As: Phenylbiguanide mbt-salt, Benzo[d]thiazole-2(3H)-thione, EINECS 226-607-2, NCI60_041791, Biguanide, 1-phenyl-, compd. with 2-benzothiazolethiol (1:1)
| Molecular Formula | C15H16N6S2 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 2.86509 |
| Topological Polar Surface Area | 118.57 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.0878 |
| Heavy Atoms | 23 |
| Complexity | 839.3783 |
Chemical Identifiers
| CAS Number | 5437-11-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=C(N)N=C(N)N.C1=CC=C2C(=C1)NC(=S)S2 |
Product Overview
Phenylbiguanide mbt-salt (CAS 5437-11-6), with molecular formula C15H16N6S2 and molecular weight 344.09 g/mol. IUPAC: 3H-1,3-benzothiazole-2-thione;1-(diaminomethylidene)-2-phenylguanidine.
Chemical Property Profile of Phenylbiguanide mbt-salt
Property Insights of Phenylbiguanide mbt-salt
The XLogP value of 2.86509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenylbiguanide mbt-salt. The TPSA of 118.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenylbiguanide mbt-salt. Following Lipinski's Rule of Five, Phenylbiguanide mbt-salt has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenylbiguanide mbt-salt?
The CAS number of Phenylbiguanide mbt-salt is 5437-11-6.
What is the molecular formula of Phenylbiguanide mbt-salt?
The molecular formula of Phenylbiguanide mbt-salt is C15H16N6S2.
What is the molecular weight of Phenylbiguanide mbt-salt?
The molecular weight of Phenylbiguanide mbt-salt is 344.09 g/mol.
Where can I buy Phenylbiguanide mbt-salt?
You can request a quote for Phenylbiguanide mbt-salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylbiguanide mbt-salt?
Yes, KEHONG BIO provides custom synthesis services for Phenylbiguanide mbt-salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.