AB00669029-01
TL;DR: AB00669029-01 (CAS 887874-35-3) is a chemical compound with molecular formula C17H11ClN4O6 and molecular weight 402.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]-2-nitrobenzamide
Also Known As: AB00669029-01, 5-chloro-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]-2-nitrobenzamide, F0608-0133, 5-chloro-N-(5-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1,3,4-oxadiazol-2-yl)-2-nitrobenzamide
| Molecular Formula | C17H11ClN4O6 |
|---|---|
| Molecular Weight | 402.04 g/mol |
| LogP | 3.3217 |
| Topological Polar Surface Area | 129.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.0367 |
| Heavy Atoms | 28 |
| Complexity | 1083.2596 |
Chemical Identifiers
| CAS Number | 887874-35-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-] |
Product Overview
AB00669029-01 (CAS 887874-35-3), with molecular formula C17H11ClN4O6 and molecular weight 402.04 g/mol. IUPAC: 5-chloro-N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]-2-nitrobenzamide.
Chemical Property Profile of AB00669029-01
Property Insights of AB00669029-01
The XLogP value of 3.3217 indicates that AB00669029-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00669029-01. Following Lipinski's Rule of Five, AB00669029-01 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 AB00669029-01?
The CAS number of AB00669029-01 is 887874-35-3.
What is the molecular formula of AB00669029-01?
The molecular formula of AB00669029-01 is C17H11ClN4O6.
What is the molecular weight of AB00669029-01?
The molecular weight of AB00669029-01 is 402.04 g/mol.
Where can I buy AB00669029-01?
You can request a quote for AB00669029-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00669029-01?
Yes, KEHONG BIO provides custom synthesis services for AB00669029-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.