N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine
TL;DR: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine (CAS 886497-71-8) is a chemical compound with molecular formula C11H10N4O2S and molecular weight 262.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine
Also Known As: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine, 1-(4-(Benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)guanidine, 2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine, guanidine, N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-, N-(4-Benzo[1,3]dioxol-5-ylthiazol-2-yl)guanidine
| Molecular Formula | C11H10N4O2S |
|---|---|
| Molecular Weight | 262.05 g/mol |
| LogP | 1.4437 |
| Topological Polar Surface Area | 95.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.05246 |
| Heavy Atoms | 18 |
| Complexity | 619.2558 |
Chemical Identifiers
| CAS Number | 886497-71-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)N=C(N)N |
Product Overview
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine (CAS 886497-71-8), with molecular formula C11H10N4O2S and molecular weight 262.05 g/mol. IUPAC: 2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine.
Chemical Property Profile of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine
Property Insights of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine
The XLogP value of 1.4437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine. The TPSA of 95.75 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine. Following Lipinski's Rule of Five, N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine 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 N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine?
The CAS number of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine is 886497-71-8.
What is the molecular formula of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine?
The molecular formula of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine is C11H10N4O2S.
What is the molecular weight of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine?
The molecular weight of N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine is 262.05 g/mol.
Where can I buy N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine?
You can request a quote for N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.