AN-648/41065989
TL;DR: AN-648/41065989 (CAS 433965-17-4) is a chemical compound with molecular formula C20H19ClN4O3S2 and molecular weight 462.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Also Known As: AN-648/41065989, N-{5-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylbenzamide, N-[5-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide, N-[5-[2-(4-chlorophenoxy)ethylcarbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide
| Molecular Formula | C20H19ClN4O3S2 |
|---|---|
| Molecular Weight | 462.06 g/mol |
| LogP | 4.03952 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 462.05872 |
| Heavy Atoms | 30 |
| Complexity | 1011.296 |
Chemical Identifiers
| CAS Number | 433965-17-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)NCCOC3=CC=C(C=C3)Cl |
Product Overview
AN-648/41065989 (CAS 433965-17-4), with molecular formula C20H19ClN4O3S2 and molecular weight 462.06 g/mol. IUPAC: N-[5-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylbenzamide.
Chemical Property Profile of AN-648/41065989
Property Insights of AN-648/41065989
The XLogP value of 4.03952 indicates that AN-648/41065989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/41065989. Following Lipinski's Rule of Five, AN-648/41065989 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 AN-648/41065989?
The CAS number of AN-648/41065989 is 433965-17-4.
What is the molecular formula of AN-648/41065989?
The molecular formula of AN-648/41065989 is C20H19ClN4O3S2.
What is the molecular weight of AN-648/41065989?
The molecular weight of AN-648/41065989 is 462.06 g/mol.
Where can I buy AN-648/41065989?
You can request a quote for AN-648/41065989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/41065989?
Yes, KEHONG BIO provides custom synthesis services for AN-648/41065989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.