F0539-1551
TL;DR: F0539-1551 (CAS 681435-97-2) is a chemical compound with molecular formula C21H22N4O4S2 and molecular weight 458.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: F0539-1551, N-{6-acetyl-3-cyano-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl}-4-(pyrrolidine-1-sulfonyl)benzamide, N-(6-acetyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
| Molecular Formula | C21H22N4O4S2 |
|---|---|
| Molecular Weight | 458.11 g/mol |
| LogP | 2.56118 |
| Topological Polar Surface Area | 110.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.10825 |
| Heavy Atoms | 31 |
| Complexity | 1173.1974 |
Chemical Identifiers
| CAS Number | 681435-97-2 |
|---|---|
| SMILES | CC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4 |
Product Overview
F0539-1551 (CAS 681435-97-2), with molecular formula C21H22N4O4S2 and molecular weight 458.11 g/mol. IUPAC: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0539-1551
Property Insights of F0539-1551
The XLogP value of 2.56118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0539-1551. The TPSA of 110.58 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-1551. Following Lipinski's Rule of Five, F0539-1551 has 1 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 F0539-1551?
The CAS number of F0539-1551 is 681435-97-2.
What is the molecular formula of F0539-1551?
The molecular formula of F0539-1551 is C21H22N4O4S2.
What is the molecular weight of F0539-1551?
The molecular weight of F0539-1551 is 458.11 g/mol.
Where can I buy F0539-1551?
You can request a quote for F0539-1551 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-1551?
Yes, KEHONG BIO provides custom synthesis services for F0539-1551 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.