4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)
TL;DR: 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) (CAS 64037-77-0) is a chemical compound with molecular formula C5H11BrN2O2S and molecular weight 241.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[amino(3-carboxypropylsulfanyl)methylidene]azanium bromide
Also Known As: 4-(Amidinothio)butyric acid, monohydrobromide, BUTYRIC ACID, 4-(AMIDINOTHIO)-, MONOHYDROBROMIDE, 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1), Butanoic acid, 4-[(aminoiminomethyl)thio]-, monohydrobromide, [amino-(4-hydroxy-4-oxobutyl)sulfanylmethylidene]azanium bromide
| Molecular Formula | C5H11BrN2O2S |
|---|---|
| Molecular Weight | 241.97 g/mol |
| LogP | -4.34 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.97246 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 64037-77-0 |
|---|---|
| SMILES | C(CC(=O)O)CSC(=[NH2+])N.[Br-] |
| InChIKey | NNLFHGPHUOOBEZ-UHFFFAOYSA-N |
Product Overview
4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) (CAS 64037-77-0), with molecular formula C5H11BrN2O2S and molecular weight 241.97 g/mol. IUPAC: [amino(3-carboxypropylsulfanyl)methylidene]azanium bromide.
Chemical Property Profile of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)
Property Insights of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)
The XLogP value of -4.34 indicates that 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1). Following Lipinski's Rule of Five, 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) has 3 hydrogen bond donor(s) and 4 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 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)?
The CAS number of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) is 64037-77-0.
What is the molecular formula of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)?
The molecular formula of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) is C5H11BrN2O2S.
What is the molecular weight of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)?
The molecular weight of 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) is 241.97 g/mol.
Where can I buy 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)?
You can request a quote for 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4-(Carbamimidoylsulfanyl)butanoic acid--hydrogen bromide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.