1H-Benzimidazol-2-ylguanidine
TL;DR: 1H-Benzimidazol-2-ylguanidine (CAS 62573-36-8) is a chemical compound with molecular formula C22H22N2O5S and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylanilino]-4-oxobutanoic acid
Also Known As: 1H-Benzimidazol-2-ylguanidine, Guanidine, 1H-benzimidazol-2-yl-, 4-[(4-{[4-(2,5-dimethyl-1h-pyrrol-1-yl)phenyl]sulfonyl}phenyl)amino]-4-oxobutanoic acid, 4-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylanilino]-4-o, 4-((4-((4-(2,5-Dimethyl-1H-pyrrol-1-yl)phenyl)sulfonyl)phenyl)amino)-4-oxobutanoic acid
| Molecular Formula | C22H22N2O5S |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.12494 |
| Heavy Atoms | 30 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 62573-36-8 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)CCC(=O)O)C |
| InChIKey | HFAUVSJJTZFPEH-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazol-2-ylguanidine (CAS 62573-36-8), with molecular formula C22H22N2O5S and molecular weight 426.12 g/mol. IUPAC: 4-[4-[4-(2,5-dimethylpyrrol-1-yl)phenyl]sulfonylanilino]-4-oxobutanoic acid.
Chemical Property Profile of 1H-Benzimidazol-2-ylguanidine
Property Insights of 1H-Benzimidazol-2-ylguanidine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazol-2-ylguanidine. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazol-2-ylguanidine. Following Lipinski's Rule of Five, 1H-Benzimidazol-2-ylguanidine has 2 hydrogen bond donor(s) and 5 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 1H-Benzimidazol-2-ylguanidine?
The CAS number of 1H-Benzimidazol-2-ylguanidine is 62573-36-8.
What is the molecular formula of 1H-Benzimidazol-2-ylguanidine?
The molecular formula of 1H-Benzimidazol-2-ylguanidine is C22H22N2O5S.
What is the molecular weight of 1H-Benzimidazol-2-ylguanidine?
The molecular weight of 1H-Benzimidazol-2-ylguanidine is 426.12 g/mol.
Where can I buy 1H-Benzimidazol-2-ylguanidine?
You can request a quote for 1H-Benzimidazol-2-ylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazol-2-ylguanidine?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazol-2-ylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.