AB00668185-01
TL;DR: AB00668185-01 (CAS 449767-24-2) is a chemical compound with molecular formula C25H26N4O4S2 and molecular weight 510.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
Also Known As: AB00668185-01, 2-(4-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)benzamido)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide, F0539-0105, 2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide, 6-methyl-2-[4-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzamido]-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxamide
| Molecular Formula | C25H26N4O4S2 |
|---|---|
| Molecular Weight | 510.14 g/mol |
| LogP | 2.8342 |
| Topological Polar Surface Area | 112.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 510.13956 |
| Heavy Atoms | 35 |
| Complexity | 1413.7185 |
Chemical Identifiers
| CAS Number | 449767-24-2 |
|---|---|
| SMILES | CN1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4 |
Product Overview
AB00668185-01 (CAS 449767-24-2), with molecular formula C25H26N4O4S2 and molecular weight 510.14 g/mol. IUPAC: 2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide.
Chemical Property Profile of AB00668185-01
Property Insights of AB00668185-01
The XLogP value of 2.8342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668185-01. The TPSA of 112.81 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668185-01. Following Lipinski's Rule of Five, AB00668185-01 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00668185-01?
The CAS number of AB00668185-01 is 449767-24-2.
What is the molecular formula of AB00668185-01?
The molecular formula of AB00668185-01 is C25H26N4O4S2.
What is the molecular weight of AB00668185-01?
The molecular weight of AB00668185-01 is 510.14 g/mol.
Where can I buy AB00668185-01?
You can request a quote for AB00668185-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668185-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668185-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.