AB00672363-01
TL;DR: AB00672363-01 (CAS 394232-06-5) is a chemical compound with molecular formula C18H14N4O2S3 and molecular weight 414.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: AB00672363-01, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide, F0748-0128, 2-(benzo[d]thiazol-2-ylthio)-N-(5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl)acetamide, 2-benzothiazol-2-ylsulfanyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C18H14N4O2S3 |
|---|---|
| Molecular Weight | 414.03 g/mol |
| LogP | 4.5542 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.0279 |
| Heavy Atoms | 27 |
| Complexity | 1042.6124 |
Chemical Identifiers
| CAS Number | 394232-06-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CSC3=NC4=CC=CC=C4S3 |
Product Overview
AB00672363-01 (CAS 394232-06-5), with molecular formula C18H14N4O2S3 and molecular weight 414.03 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of AB00672363-01
Property Insights of AB00672363-01
The XLogP value of 4.5542 indicates that AB00672363-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672363-01. Following Lipinski's Rule of Five, AB00672363-01 has 1 hydrogen bond donor(s) and 8 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 AB00672363-01?
The CAS number of AB00672363-01 is 394232-06-5.
What is the molecular formula of AB00672363-01?
The molecular formula of AB00672363-01 is C18H14N4O2S3.
What is the molecular weight of AB00672363-01?
The molecular weight of AB00672363-01 is 414.03 g/mol.
Where can I buy AB00672363-01?
You can request a quote for AB00672363-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672363-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672363-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.