AB00724758-01
TL;DR: AB00724758-01 (CAS 5529-06-6) is a chemical compound with molecular formula C19H16F2N6O3S and molecular weight 446.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one
Also Known As: AB00724758-01, 4-[2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one, 4-[({4-Amino-5-[4-(difluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]-3,4-dihydroquinoxalin-2(1H)-one
| Molecular Formula | C19H16F2N6O3S |
|---|---|
| Molecular Weight | 446.10 g/mol |
| LogP | 2.3377 |
| Topological Polar Surface Area | 115.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.09726 |
| Heavy Atoms | 31 |
| Complexity | 1122.0858 |
Chemical Identifiers
| CAS Number | 5529-06-6 |
|---|---|
| SMILES | C1C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3N)C4=CC=C(C=C4)OC(F)F |
Product Overview
AB00724758-01 (CAS 5529-06-6), with molecular formula C19H16F2N6O3S and molecular weight 446.10 g/mol. IUPAC: 4-[2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one.
Chemical Property Profile of AB00724758-01
Property Insights of AB00724758-01
The XLogP value of 2.3377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00724758-01. The TPSA of 115.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00724758-01. Following Lipinski's Rule of Five, AB00724758-01 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 AB00724758-01?
The CAS number of AB00724758-01 is 5529-06-6.
What is the molecular formula of AB00724758-01?
The molecular formula of AB00724758-01 is C19H16F2N6O3S.
What is the molecular weight of AB00724758-01?
The molecular weight of AB00724758-01 is 446.10 g/mol.
Where can I buy AB00724758-01?
You can request a quote for AB00724758-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00724758-01?
Yes, KEHONG BIO provides custom synthesis services for AB00724758-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.