AB00669041-01
TL;DR: AB00669041-01 (CAS 851094-89-8) is a chemical compound with molecular formula C15H10N4O6S and molecular weight 374.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide
Also Known As: AB00669041-01, F0608-0188, N-[5-(5,6-dihydro-1,4-dioxin-2-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide, N-(5-(5,6-dihydro-1,4-dioxin-2-yl)-1,3,4-oxadiazol-2-yl)-5-nitrobenzo[b]thiophene-2-carboxamide, N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide
| Molecular Formula | C15H10N4O6S |
|---|---|
| Molecular Weight | 374.03 g/mol |
| LogP | 2.79 |
| Topological Polar Surface Area | 129.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.0321 |
| Heavy Atoms | 26 |
| Complexity | 1039.8677 |
Chemical Identifiers
| CAS Number | 851094-89-8 |
|---|---|
| SMILES | C1COC(=CO1)C2=NN=C(O2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-] |
Product Overview
AB00669041-01 (CAS 851094-89-8), with molecular formula C15H10N4O6S and molecular weight 374.03 g/mol. IUPAC: N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AB00669041-01
Property Insights of AB00669041-01
The XLogP value of 2.79 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00669041-01. The TPSA of 129.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00669041-01. Following Lipinski's Rule of Five, AB00669041-01 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 AB00669041-01?
The CAS number of AB00669041-01 is 851094-89-8.
What is the molecular formula of AB00669041-01?
The molecular formula of AB00669041-01 is C15H10N4O6S.
What is the molecular weight of AB00669041-01?
The molecular weight of AB00669041-01 is 374.03 g/mol.
Where can I buy AB00669041-01?
You can request a quote for AB00669041-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00669041-01?
Yes, KEHONG BIO provides custom synthesis services for AB00669041-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.