F0539-2102
TL;DR: F0539-2102 (CAS 449782-64-3) is a chemical compound with molecular formula C29H33N3O5S2 and molecular weight 567.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
Also Known As: F0539-2102, methyl 2-(4-((3,4-dihydroquinolin-1(2H)-yl)sulfonyl)benzamido)-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 5,5,7,7-tetramethyl-2-[4-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamido]-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C29H33N3O5S2 |
|---|---|
| Molecular Weight | 567.19 g/mol |
| LogP | 5.0879 |
| Topological Polar Surface Area | 104.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 567.18616 |
| Heavy Atoms | 39 |
| Complexity | 1555.9283 |
Chemical Identifiers
| CAS Number | 449782-64-3 |
|---|---|
| SMILES | CC1(CC2=C(C(N1)(C)C)SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC5=CC=CC=C54)C |
Product Overview
F0539-2102 (CAS 449782-64-3), with molecular formula C29H33N3O5S2 and molecular weight 567.19 g/mol. IUPAC: methyl 2-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoyl]amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of F0539-2102
Property Insights of F0539-2102
The XLogP value of 5.0879 indicates that F0539-2102 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.81 Ų falls within the moderate polarity range, balancing permeability and solubility for F0539-2102. Following Lipinski's Rule of Five, F0539-2102 has 2 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 F0539-2102?
The CAS number of F0539-2102 is 449782-64-3.
What is the molecular formula of F0539-2102?
The molecular formula of F0539-2102 is C29H33N3O5S2.
What is the molecular weight of F0539-2102?
The molecular weight of F0539-2102 is 567.19 g/mol.
Where can I buy F0539-2102?
You can request a quote for F0539-2102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0539-2102?
Yes, KEHONG BIO provides custom synthesis services for F0539-2102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.