F2701-0582
TL;DR: F2701-0582 (CAS 886958-02-7) is a chemical compound with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(methylcarbamoyl)-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Also Known As: F2701-0582, methyl 3-(methylcarbamoyl)-2-(2-methylpropanamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-6-carboxylate, methyl 2-isobutyramido-3-(methylcarbamoyl)-4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate, methyl 3-(methylcarbamoyl)-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
| Molecular Formula | C15H21N3O4S |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 1.8267 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.12527 |
| Heavy Atoms | 23 |
| Complexity | 638.9117 |
Chemical Identifiers
| CAS Number | 886958-02-7 |
|---|---|
| SMILES | CC(C)C(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)OC)C(=O)NC |
Product Overview
F2701-0582 (CAS 886958-02-7), with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol. IUPAC: methyl 3-(methylcarbamoyl)-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate.
Chemical Property Profile of F2701-0582
Property Insights of F2701-0582
The XLogP value of 1.8267 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2701-0582. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for F2701-0582. Following Lipinski's Rule of Five, F2701-0582 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 F2701-0582?
The CAS number of F2701-0582 is 886958-02-7.
What is the molecular formula of F2701-0582?
The molecular formula of F2701-0582 is C15H21N3O4S.
What is the molecular weight of F2701-0582?
The molecular weight of F2701-0582 is 339.13 g/mol.
Where can I buy F2701-0582?
You can request a quote for F2701-0582 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2701-0582?
Yes, KEHONG BIO provides custom synthesis services for F2701-0582 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.