AB00677806-01
TL;DR: AB00677806-01 (CAS 878061-63-3) is a chemical compound with molecular formula C18H16N4O4S and molecular weight 384.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,5-dimethoxyphenyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-1,3,4-oxadiazol-2-amine
Also Known As: AB00677806-01, F2020-0597, N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-5-methoxy-1,3-benzothiazol-2-amine, 5-(3,5-dimethoxyphenyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-1,3,4-oxadiazol-2-amine, 5-(3,5-dimethoxyphenyl)-N-(5-methoxybenzo[d]thiazol-2-yl)-1,3,4-oxadiazol-2-amine
| Molecular Formula | C18H16N4O4S |
|---|---|
| Molecular Weight | 384.09 g/mol |
| LogP | 4.1157 |
| Topological Polar Surface Area | 91.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.08923 |
| Heavy Atoms | 27 |
| Complexity | 1069.8575 |
Chemical Identifiers
| CAS Number | 878061-63-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)SC(=N2)NC3=NN=C(O3)C4=CC(=CC(=C4)OC)OC |
Product Overview
AB00677806-01 (CAS 878061-63-3), with molecular formula C18H16N4O4S and molecular weight 384.09 g/mol. IUPAC: 5-(3,5-dimethoxyphenyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-1,3,4-oxadiazol-2-amine.
Chemical Property Profile of AB00677806-01
Property Insights of AB00677806-01
The XLogP value of 4.1157 indicates that AB00677806-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00677806-01. Following Lipinski's Rule of Five, AB00677806-01 has 1 hydrogen bond donor(s) and 9 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 AB00677806-01?
The CAS number of AB00677806-01 is 878061-63-3.
What is the molecular formula of AB00677806-01?
The molecular formula of AB00677806-01 is C18H16N4O4S.
What is the molecular weight of AB00677806-01?
The molecular weight of AB00677806-01 is 384.09 g/mol.
Where can I buy AB00677806-01?
You can request a quote for AB00677806-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00677806-01?
Yes, KEHONG BIO provides custom synthesis services for AB00677806-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.