AB00670977-01
TL;DR: AB00670977-01 (CAS 862976-90-7) is a chemical compound with molecular formula C18H14N4O5S and molecular weight 398.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-amine
Also Known As: AB00670977-01, F0646-8811, N-(5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl)-[1,3]dioxolo[4',5':4,5]benzo[1,2-d]thiazol-6-amine, N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-4,6-dioxa-10-thia-12-azatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,7,11-tetraen-11-amine, N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-amine
| Molecular Formula | C18H14N4O5S |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 3.8358 |
| Topological Polar Surface Area | 100.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.06848 |
| Heavy Atoms | 28 |
| Complexity | 1131.2101 |
Chemical Identifiers
| CAS Number | 862976-90-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NN=C(O2)NC3=NC4=CC5=C(C=C4S3)OCO5)OC |
Product Overview
AB00670977-01 (CAS 862976-90-7), with molecular formula C18H14N4O5S and molecular weight 398.07 g/mol. IUPAC: N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-[1,3]dioxolo[4,5-f][1,3]benzothiazol-6-amine.
Chemical Property Profile of AB00670977-01
Property Insights of AB00670977-01
The XLogP value of 3.8358 indicates that AB00670977-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00670977-01. Following Lipinski's Rule of Five, AB00670977-01 has 1 hydrogen bond donor(s) and 10 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 AB00670977-01?
The CAS number of AB00670977-01 is 862976-90-7.
What is the molecular formula of AB00670977-01?
The molecular formula of AB00670977-01 is C18H14N4O5S.
What is the molecular weight of AB00670977-01?
The molecular weight of AB00670977-01 is 398.07 g/mol.
Where can I buy AB00670977-01?
You can request a quote for AB00670977-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00670977-01?
Yes, KEHONG BIO provides custom synthesis services for AB00670977-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.