BAS 00338279
TL;DR: BAS 00338279 (CAS 102609-55-2) is a chemical compound with molecular formula C25H25N3O3S2 and molecular weight 479.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(benzoylcarbamothioylamino)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: BAS 00338279, AB00081520-01, AJ-292/40175627, ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, ethyl 2-(benzoylcarbamothioylamino)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C25H25N3O3S2 |
|---|---|
| Molecular Weight | 479.13 g/mol |
| LogP | 4.6099 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.13373 |
| Heavy Atoms | 33 |
| Complexity | 1146.4636 |
Chemical Identifiers
| CAS Number | 102609-55-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NC(=O)C4=CC=CC=C4 |
Product Overview
BAS 00338279 (CAS 102609-55-2), with molecular formula C25H25N3O3S2 and molecular weight 479.13 g/mol. IUPAC: ethyl 2-(benzoylcarbamothioylamino)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of BAS 00338279
Property Insights of BAS 00338279
The XLogP value of 4.6099 indicates that BAS 00338279 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00338279. Following Lipinski's Rule of Five, BAS 00338279 has 2 hydrogen bond donor(s) and 6 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 BAS 00338279?
The CAS number of BAS 00338279 is 102609-55-2.
What is the molecular formula of BAS 00338279?
The molecular formula of BAS 00338279 is C25H25N3O3S2.
What is the molecular weight of BAS 00338279?
The molecular weight of BAS 00338279 is 479.13 g/mol.
Where can I buy BAS 00338279?
You can request a quote for BAS 00338279 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00338279?
Yes, KEHONG BIO provides custom synthesis services for BAS 00338279 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.