AQ-088/42014007
TL;DR: AQ-088/42014007 (CAS 724451-29-0) is a chemical compound with molecular formula C22H18N4O3S2 and molecular weight 450.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxyacetamide
Also Known As: AQ-088/42014007, N-(5-{[2-(1-naphthylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide, F1838-0849, N-[5-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxyacetamide, N-[5-({[(NAPHTHALEN-1-YL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]-2-PHENOXYACETAMIDE
| Molecular Formula | C22H18N4O3S2 |
|---|---|
| Molecular Weight | 450.08 g/mol |
| LogP | 4.4396 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 450.08203 |
| Heavy Atoms | 31 |
| Complexity | 1192.3278 |
Chemical Identifiers
| CAS Number | 724451-29-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC4=CC=CC=C43 |
Product Overview
AQ-088/42014007 (CAS 724451-29-0), with molecular formula C22H18N4O3S2 and molecular weight 450.08 g/mol. IUPAC: N-[5-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxyacetamide.
Chemical Property Profile of AQ-088/42014007
Property Insights of AQ-088/42014007
The XLogP value of 4.4396 indicates that AQ-088/42014007 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 AQ-088/42014007. Following Lipinski's Rule of Five, AQ-088/42014007 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 AQ-088/42014007?
The CAS number of AQ-088/42014007 is 724451-29-0.
What is the molecular formula of AQ-088/42014007?
The molecular formula of AQ-088/42014007 is C22H18N4O3S2.
What is the molecular weight of AQ-088/42014007?
The molecular weight of AQ-088/42014007 is 450.08 g/mol.
Where can I buy AQ-088/42014007?
You can request a quote for AQ-088/42014007 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-088/42014007?
Yes, KEHONG BIO provides custom synthesis services for AQ-088/42014007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.