BAS 00067971
TL;DR: BAS 00067971 (CAS 299969-88-3) is a chemical compound with molecular formula C8H7N7O5 and molecular weight 281.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-amino-1,2,5-oxadiazol-3-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea
Also Known As: BAS 00067971, (E)-N-(4-amino-1,2,5-oxadiazol-3-yl)-2-((5-nitrofuran-2-yl)methylene)hydrazinecarboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea, {[(1E)-2-(5-nitro(2-furyl))-1-azavinyl]amino}-N-(4-amino(1,2,5-oxadiazol-3-yl) )carboxamide
| Molecular Formula | C8H7N7O5 |
|---|---|
| Molecular Weight | 281.05 g/mol |
| LogP | 0.3086 |
| Topological Polar Surface Area | 174.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.05087 |
| Heavy Atoms | 20 |
| Complexity | 659.7298 |
Chemical Identifiers
| CAS Number | 299969-88-3 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=O)NC2=NON=C2N |
Product Overview
BAS 00067971 (CAS 299969-88-3), with molecular formula C8H7N7O5 and molecular weight 281.05 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea.
Chemical Property Profile of BAS 00067971
Property Insights of BAS 00067971
The XLogP value of 0.3086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00067971. The TPSA of 174.71 Ų indicates high polarity, suggesting BAS 00067971 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00067971 has 3 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 BAS 00067971?
The CAS number of BAS 00067971 is 299969-88-3.
What is the molecular formula of BAS 00067971?
The molecular formula of BAS 00067971 is C8H7N7O5.
What is the molecular weight of BAS 00067971?
The molecular weight of BAS 00067971 is 281.05 g/mol.
Where can I buy BAS 00067971?
You can request a quote for BAS 00067971 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00067971?
Yes, KEHONG BIO provides custom synthesis services for BAS 00067971 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.