BAS 00234346
TL;DR: BAS 00234346 (CAS 331650-50-1) is a chemical compound with molecular formula C14H9ClN6O5 and molecular weight 376.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-[(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-1,2,5-oxadiazole-3-carboxamide
Also Known As: BAS 00234346, 4-amino-N-[(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-1,2,5-oxadiazole-3-carboxamide, 4-amino-N'-[(5-{2-chloro-5-nitrophenyl}-2-furyl)methylene]-1,2,5-oxadiazole-3-carbohydrazide, (E)-4-amino-N'-((5-(2-chloro-5-nitrophenyl)furan-2-yl)methylene)-1,2,5-oxadiazole-3-carbohydrazide, 4-amino-N'-{(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1,2,5-oxadiazole-3-carbohydrazide
| Molecular Formula | C14H9ClN6O5 |
|---|---|
| Molecular Weight | 376.03 g/mol |
| LogP | 2.2373 |
| Topological Polar Surface Area | 162.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.0323 |
| Heavy Atoms | 26 |
| Complexity | 1010.9335 |
Chemical Identifiers
| CAS Number | 331650-50-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C2=CC=C(O2)/C=N/NC(=O)C3=NON=C3N)Cl |
Product Overview
BAS 00234346 (CAS 331650-50-1), with molecular formula C14H9ClN6O5 and molecular weight 376.03 g/mol. IUPAC: 4-amino-N-[(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-1,2,5-oxadiazole-3-carboxamide.
Chemical Property Profile of BAS 00234346
Property Insights of BAS 00234346
The XLogP value of 2.2373 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00234346. The TPSA of 162.68 Ų indicates high polarity, suggesting BAS 00234346 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00234346 has 2 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 00234346?
The CAS number of BAS 00234346 is 331650-50-1.
What is the molecular formula of BAS 00234346?
The molecular formula of BAS 00234346 is C14H9ClN6O5.
What is the molecular weight of BAS 00234346?
The molecular weight of BAS 00234346 is 376.03 g/mol.
Where can I buy BAS 00234346?
You can request a quote for BAS 00234346 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00234346?
Yes, KEHONG BIO provides custom synthesis services for BAS 00234346 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.