AB00112111-01
TL;DR: AB00112111-01 (CAS 364384-06-5) is a chemical compound with molecular formula C26H20N4O3S and molecular weight 468.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide
Also Known As: AB00112111-01, 3-methoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide, 3-methoxy-N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-2-naphthamide, 3-methoxy-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}naphthalene-2-carboxamide
| Molecular Formula | C26H20N4O3S |
|---|---|
| Molecular Weight | 468.13 g/mol |
| LogP | 5.48682 |
| Topological Polar Surface Area | 89.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.1256 |
| Heavy Atoms | 34 |
| Complexity | 1527.8403 |
Chemical Identifiers
| CAS Number | 364384-06-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC=N3)NC(=S)NC(=O)C4=CC5=CC=CC=C5C=C4OC |
Product Overview
AB00112111-01 (CAS 364384-06-5), with molecular formula C26H20N4O3S and molecular weight 468.13 g/mol. IUPAC: 3-methoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide.
Chemical Property Profile of AB00112111-01
Property Insights of AB00112111-01
The XLogP value of 5.48682 indicates that AB00112111-01 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 AB00112111-01. Following Lipinski's Rule of Five, AB00112111-01 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 AB00112111-01?
The CAS number of AB00112111-01 is 364384-06-5.
What is the molecular formula of AB00112111-01?
The molecular formula of AB00112111-01 is C26H20N4O3S.
What is the molecular weight of AB00112111-01?
The molecular weight of AB00112111-01 is 468.13 g/mol.
Where can I buy AB00112111-01?
You can request a quote for AB00112111-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00112111-01?
Yes, KEHONG BIO provides custom synthesis services for AB00112111-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.