AB00668088-01
TL;DR: AB00668088-01 (CAS 476462-40-5) is a chemical compound with molecular formula C20H15N3O5S and molecular weight 409.07 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-thiadiazol-2-yl]-2-oxochromene-3-carboxamide
Also Known As: AB00668088-01, F0529-0313, N-(5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl)-2-oxo-2H-chromene-3-carboxamide, N-[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-oxo-2H-chromene-3-carboxamide, N-[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-oxochromene-3-carboxamide
| Molecular Formula | C20H15N3O5S |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 3.581 |
| Topological Polar Surface Area | 103.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.07324 |
| Heavy Atoms | 29 |
| Complexity | 1264.4492 |
Chemical Identifiers
| CAS Number | 476462-40-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NN=C(S2)NC(=O)C3=CC4=CC=CC=C4OC3=O)OC |
Product Overview
AB00668088-01 (CAS 476462-40-5), with molecular formula C20H15N3O5S and molecular weight 409.07 g/mol. IUPAC: N-[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-2-oxochromene-3-carboxamide.
Chemical Property Profile of AB00668088-01
Property Insights of AB00668088-01
The XLogP value of 3.581 indicates that AB00668088-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668088-01. Following Lipinski's Rule of Five, AB00668088-01 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 AB00668088-01?
The CAS number of AB00668088-01 is 476462-40-5.
What is the molecular formula of AB00668088-01?
The molecular formula of AB00668088-01 is C20H15N3O5S.
What is the molecular weight of AB00668088-01?
The molecular weight of AB00668088-01 is 409.07 g/mol.
Where can I buy AB00668088-01?
You can request a quote for AB00668088-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668088-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668088-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.