AB00109014-01
TL;DR: AB00109014-01 (CAS 428498-48-0) is a chemical compound with molecular formula C21H15BrN4O3S and molecular weight 482.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-methoxy-N-[[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide
Also Known As: AB00109014-01, 5-bromo-2-methoxy-N-[[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide, 5-bromo-2-methoxy-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide, 3-(5-BROMO-2-METHOXYBENZOYL)-1-(3-{[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YL}PHENYL)THIOUREA
| Molecular Formula | C21H15BrN4O3S |
|---|---|
| Molecular Weight | 482.00 g/mol |
| LogP | 4.7877 |
| Topological Polar Surface Area | 89.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 482.00482 |
| Heavy Atoms | 30 |
| Complexity | 1224.979 |
Chemical Identifiers
| CAS Number | 428498-48-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=C(O3)C=CC=N4 |
Product Overview
AB00109014-01 (CAS 428498-48-0), with molecular formula C21H15BrN4O3S and molecular weight 482.00 g/mol. IUPAC: 5-bromo-2-methoxy-N-[[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of AB00109014-01
Property Insights of AB00109014-01
The XLogP value of 4.7877 indicates that AB00109014-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.28 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00109014-01. Following Lipinski's Rule of Five, AB00109014-01 has 2 hydrogen bond donor(s) and 6 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 AB00109014-01?
The CAS number of AB00109014-01 is 428498-48-0.
What is the molecular formula of AB00109014-01?
The molecular formula of AB00109014-01 is C21H15BrN4O3S.
What is the molecular weight of AB00109014-01?
The molecular weight of AB00109014-01 is 482.00 g/mol.
Where can I buy AB00109014-01?
You can request a quote for AB00109014-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00109014-01?
Yes, KEHONG BIO provides custom synthesis services for AB00109014-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.