F0539-0572
TL;DR: F0539-0572 (CAS 681177-82-2) is a chemical compound with molecular formula C31H38N4O3S3 and molecular weight 610.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(dibutylsulfamoyl)benzamide
Also Known As: F0539-0572, N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-4-(dibutylsulfamoyl)benzamide, N-(3-(benzo[d]thiazol-2-yl)-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-4-(N,N-dibutylsulfamoyl)benzamide, N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(dibutylsulfamoyl)benzamide
| Molecular Formula | C31H38N4O3S3 |
|---|---|
| Molecular Weight | 610.21 g/mol |
| LogP | 7.246 |
| Topological Polar Surface Area | 82.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 610.21063 |
| Heavy Atoms | 41 |
| Complexity | 1568.2777 |
Chemical Identifiers
| CAS Number | 681177-82-2 |
|---|---|
| SMILES | CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)CC)C4=NC5=CC=CC=C5S4 |
Product Overview
F0539-0572 (CAS 681177-82-2), with molecular formula C31H38N4O3S3 and molecular weight 610.21 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(dibutylsulfamoyl)benzamide.
Chemical Property Profile of F0539-0572
Property Insights of F0539-0572
The XLogP value of 7.246 indicates that F0539-0572 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.61 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-0572. Following Lipinski's Rule of Five, F0539-0572 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0539-0572?
The CAS number of F0539-0572 is 681177-82-2.
What is the molecular formula of F0539-0572?
The molecular formula of F0539-0572 is C31H38N4O3S3.
What is the molecular weight of F0539-0572?
The molecular weight of F0539-0572 is 610.21 g/mol.
Where can I buy F0539-0572?
You can request a quote for F0539-0572 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-0572?
Yes, KEHONG BIO provides custom synthesis services for F0539-0572 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.