RefChem:537909
TL;DR: RefChem:537909 (CAS 855715-35-4) is a chemical compound with molecular formula C10H6N2O2S and molecular weight 218.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-thia-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene-4-carboxylic acid
Also Known As: thieno[2',3':4,5]imidazo[1,2-a]pyridine-2-carboxylic acid, 5-thia-1,7-diazatricyclo[6.4.0.0,2,6]dodeca-2(6),3,7,9,11-pentaene-4-carboxylic acid, Thieno(2',3':4,5)imidazo(1,2-a)pyridine-2-carboxylic acid, 5-thia-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene-4-carboxylic acid, Thieno[2a(2),3a(2):4,5]imidazo[1,2-a]pyridine-2-carboxylic acid
| Molecular Formula | C10H6N2O2S |
|---|---|
| Molecular Weight | 218.01 g/mol |
| LogP | 2.2472 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.015 |
| Heavy Atoms | 15 |
| Complexity | 668.2276 |
Chemical Identifiers
| CAS Number | 855715-35-4 |
|---|---|
| SMILES | C1=CC2=NC3=C(N2C=C1)C=C(S3)C(=O)O |
Product Overview
RefChem:537909 (CAS 855715-35-4), with molecular formula C10H6N2O2S and molecular weight 218.01 g/mol. IUPAC: 5-thia-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene-4-carboxylic acid.
Chemical Property Profile of RefChem:537909
Property Insights of RefChem:537909
The XLogP value of 2.2472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:537909. With a topological polar surface area (TPSA) of 54.6 Ų, RefChem:537909 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:537909 has 1 hydrogen bond donor(s) and 3 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 RefChem:537909?
The CAS number of RefChem:537909 is 855715-35-4.
What is the molecular formula of RefChem:537909?
The molecular formula of RefChem:537909 is C10H6N2O2S.
What is the molecular weight of RefChem:537909?
The molecular weight of RefChem:537909 is 218.01 g/mol.
Where can I buy RefChem:537909?
You can request a quote for RefChem:537909 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:537909?
Yes, KEHONG BIO provides custom synthesis services for RefChem:537909 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.