Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)
TL;DR: Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) (CAS 2778-97-4) is a chemical compound with molecular formula C8H20N4O4S2 and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sulfuric acid;2-[2-(1,4-thiazepan-4-yl)ethyl]guanidine
Also Known As: Guanidine, (2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate, (2-(Tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)guanidine sulfate, Guanidine, (2-(hexahydro-1,4-thiazepin-4-yl)ethyl)-, sulfate, sulfuric acid; 2-[2-(1,4-thiazepan-4-yl)ethyl]guanidine, Sulfuric acid--N''-[2-(1,4-thiazepan-4-yl)ethyl]guanidine (1/1)
| Molecular Formula | C8H20N4O4S2 |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | -0.9541 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.0926 |
| Heavy Atoms | 18 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 2778-97-4 |
|---|---|
| SMILES | C1CN(CCSC1)CCN=C(N)N.OS(=O)(=O)O |
| InChIKey | YIUQTUPFJAPHTD-UHFFFAOYSA-N |
Product Overview
Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) (CAS 2778-97-4), with molecular formula C8H20N4O4S2 and molecular weight 300.09 g/mol. IUPAC: sulfuric acid;2-[2-(1,4-thiazepan-4-yl)ethyl]guanidine.
Chemical Property Profile of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)
Property Insights of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)
The XLogP value of -0.9541 indicates that Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) has 4 hydrogen bond donor(s) and 7 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 Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)?
The CAS number of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) is 2778-97-4.
What is the molecular formula of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)?
The molecular formula of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) is C8H20N4O4S2.
What is the molecular weight of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)?
The molecular weight of Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) is 300.09 g/mol.
Where can I buy Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)?
You can request a quote for Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?)?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, N-(2-(tetrahydro-1,4-thiazepin-4(5H)-yl)ethyl)-, sulfate (1:?) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.