RefChem:497634
TL;DR: RefChem:497634 (CAS 400863-62-9) is a chemical compound with molecular formula C15H15N5OS2 and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),5,8-tetraene-5-carboxamide
Also Known As: BAS 03673532, 3-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide, AB00114868-01, AN-919/15231369, 3-AMINO-N-(5-ETHYL-1,3,4-THIADIAZOL-2-YL)-6,7-DIHYDRO-5H-CYCLOPENTA(B)THIENO(3,2-E)PYRIDINE-2-CARBOXAMIDE
| Molecular Formula | C15H15N5OS2 |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 3.0334 |
| Topological Polar Surface Area | 93.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.0718 |
| Heavy Atoms | 23 |
| Complexity | 914.1182 |
Chemical Identifiers
| CAS Number | 400863-62-9 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=C(C3=C(S2)N=C4CCCC4=C3)N |
Product Overview
RefChem:497634 (CAS 400863-62-9), with molecular formula C15H15N5OS2 and molecular weight 345.07 g/mol. IUPAC: 6-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),5,8-tetraene-5-carboxamide.
Chemical Property Profile of RefChem:497634
Property Insights of RefChem:497634
The XLogP value of 3.0334 indicates that RefChem:497634 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.79 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:497634. Following Lipinski's Rule of Five, RefChem:497634 has 2 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 RefChem:497634?
The CAS number of RefChem:497634 is 400863-62-9.
What is the molecular formula of RefChem:497634?
The molecular formula of RefChem:497634 is C15H15N5OS2.
What is the molecular weight of RefChem:497634?
The molecular weight of RefChem:497634 is 345.07 g/mol.
Where can I buy RefChem:497634?
You can request a quote for RefChem:497634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:497634?
Yes, KEHONG BIO provides custom synthesis services for RefChem:497634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.