AB01279548-01
TL;DR: AB01279548-01 (CAS 694507-59-0) is a chemical compound with molecular formula C20H19N5O3S and molecular weight 409.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide
Also Known As: AB01279548-01, AN-698/42147550, 2-{[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide, 2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide
| Molecular Formula | C20H19N5O3S |
|---|---|
| Molecular Weight | 409.12 g/mol |
| LogP | 3.45292 |
| Topological Polar Surface Area | 108.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.12085 |
| Heavy Atoms | 29 |
| Complexity | 1166.7999 |
Chemical Identifiers
| CAS Number | 694507-59-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC4=C(O3)C(=CC=C4)OC |
Product Overview
AB01279548-01 (CAS 694507-59-0), with molecular formula C20H19N5O3S and molecular weight 409.12 g/mol. IUPAC: 2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide.
Chemical Property Profile of AB01279548-01
Property Insights of AB01279548-01
The XLogP value of 3.45292 indicates that AB01279548-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01279548-01. Following Lipinski's Rule of Five, AB01279548-01 has 2 hydrogen bond donor(s) and 7 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 AB01279548-01?
The CAS number of AB01279548-01 is 694507-59-0.
What is the molecular formula of AB01279548-01?
The molecular formula of AB01279548-01 is C20H19N5O3S.
What is the molecular weight of AB01279548-01?
The molecular weight of AB01279548-01 is 409.12 g/mol.
Where can I buy AB01279548-01?
You can request a quote for AB01279548-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01279548-01?
Yes, KEHONG BIO provides custom synthesis services for AB01279548-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.