1-十二烷基双胍半硫酸盐水合物
TL;DR: 1-十二烷基双胍半硫酸盐水合物 (CAS 101491-42-3) is a chemical compound with molecular formula C14H33N5O4S and molecular weight 367.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-十二烷基双胍半硫酸盐水合物
1-(diaminomethylidene)-2-dodecylguanidine;sulfuric acid
Also Known As: n-Dodecylbiguanide semisulfate hydrate, BIGUANIDE, 1-DODECYL-, HEMISULFATE, HYDRATE, C14H31N5.1/2H2O4S.H2O, C14-H31-N5.1/2H2-O4-S.H2-O, 1-(diaminomethylidene)-2-dodecylguanidine sulfate(1:1)
| Molecular Formula | C14H33N5O4S |
|---|---|
| Molecular Weight | 367.23 g/mol |
| LogP | 1.84 |
| Topological Polar Surface Area | 186.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 367.2253 |
| Heavy Atoms | 24 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 101491-42-3 |
|---|---|
| SMILES | CCCCCCCCCCCCN=C(N)N=C(N)N.OS(=O)(=O)O |
| InChIKey | ITHRIIVJLOSNTI-UHFFFAOYSA-N |
Product Overview
1-十二烷基双胍半硫酸盐水合物 (CAS 101491-42-3), with molecular formula C14H33N5O4S and molecular weight 367.23 g/mol. IUPAC: 1-(diaminomethylidene)-2-dodecylguanidine;sulfuric acid.
Chemical Property Profile of 1-十二烷基双胍半硫酸盐水合物
Property Insights of 1-十二烷基双胍半硫酸盐水合物
The XLogP value of 1.84 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-十二烷基双胍半硫酸盐水合物. The TPSA of 186.0 Ų indicates high polarity, suggesting 1-十二烷基双胍半硫酸盐水合物 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-十二烷基双胍半硫酸盐水合物 has 5 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 1-十二烷基双胍半硫酸盐水合物?
The CAS number of 1-十二烷基双胍半硫酸盐水合物 is 101491-42-3.
What is the molecular formula of 1-十二烷基双胍半硫酸盐水合物?
The molecular formula of 1-十二烷基双胍半硫酸盐水合物 is C14H33N5O4S.
What is the molecular weight of 1-十二烷基双胍半硫酸盐水合物?
The molecular weight of 1-十二烷基双胍半硫酸盐水合物 is 367.23 g/mol.
Where can I buy 1-十二烷基双胍半硫酸盐水合物?
You can request a quote for 1-十二烷基双胍半硫酸盐水合物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-十二烷基双胍半硫酸盐水合物?
Yes, KEHONG BIO provides custom synthesis services for 1-十二烷基双胍半硫酸盐水合物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.