K906-2981
TL;DR: K906-2981 (CAS 899703-33-4) is a chemical compound with molecular formula C21H22ClN3O5S and molecular weight 463.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[6-(2-methylpiperidin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetamide
Also Known As: K906-2981, N-(4-Chlorophenyl)-6-[(2-methyl-1-piperidinyl)sulfonyl]-2-oxo-3(2H)-benzoxazoleacetamide, N-(4-chlorophenyl)-2-[6-[(2-methyl-1-piperidyl)sulfonyl]-2-oxo-benzooxazol-3-yl]acetamide, N-(4-chlorophenyl)-2-[6-(2-methylpiperidin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetamide, N-(4-Chlorophenyl)-2-[6-(2-methylpiperidine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetamide
| Molecular Formula | C21H22ClN3O5S |
|---|---|
| Molecular Weight | 463.10 g/mol |
| LogP | 3.4497 |
| Topological Polar Surface Area | 101.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.09686 |
| Heavy Atoms | 31 |
| Complexity | 1280.5826 |
Chemical Identifiers
| CAS Number | 899703-33-4 |
|---|---|
| SMILES | CC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)NC4=CC=C(C=C4)Cl |
Product Overview
K906-2981 (CAS 899703-33-4), with molecular formula C21H22ClN3O5S and molecular weight 463.10 g/mol. IUPAC: N-(4-chlorophenyl)-2-[6-(2-methylpiperidin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetamide.
Chemical Property Profile of K906-2981
Property Insights of K906-2981
The XLogP value of 3.4497 indicates that K906-2981 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.62 Ų falls within the moderate polarity range, balancing permeability and solubility for K906-2981. Following Lipinski's Rule of Five, K906-2981 has 1 hydrogen bond donor(s) and 5 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 K906-2981?
The CAS number of K906-2981 is 899703-33-4.
What is the molecular formula of K906-2981?
The molecular formula of K906-2981 is C21H22ClN3O5S.
What is the molecular weight of K906-2981?
The molecular weight of K906-2981 is 463.10 g/mol.
Where can I buy K906-2981?
You can request a quote for K906-2981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for K906-2981?
Yes, KEHONG BIO provides custom synthesis services for K906-2981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.