BAS 11780218
TL;DR: BAS 11780218 (CAS 876895-17-9) is a chemical compound with molecular formula C21H15N3O6 and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methyl-4-[(5-nitrofuran-2-carbonyl)amino]phenyl]-1-benzofuran-2-carboxamide
Also Known As: BAS 11780218, N-(2-methyl-4-(5-nitrofuran-2-carboxamido)phenyl)benzofuran-2-carboxamide, N-(2-methyl-4-{[(5-nitrofuran-2-yl)carbonyl]amino}phenyl)-1-benzofuran-2-carboxamide, N-[2-methyl-4-[(5-nitrofuran-2-carbonyl)amino]phenyl]-1-benzofuran-2-carboxamide
| Molecular Formula | C21H15N3O6 |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 4.74702 |
| Topological Polar Surface Area | 127.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.0961 |
| Heavy Atoms | 30 |
| Complexity | 1253.8914 |
Chemical Identifiers
| CAS Number | 876895-17-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4O3 |
Product Overview
BAS 11780218 (CAS 876895-17-9), with molecular formula C21H15N3O6 and molecular weight 405.10 g/mol. IUPAC: N-[2-methyl-4-[(5-nitrofuran-2-carbonyl)amino]phenyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of BAS 11780218
Property Insights of BAS 11780218
The XLogP value of 4.74702 indicates that BAS 11780218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11780218. Following Lipinski's Rule of Five, BAS 11780218 has 2 hydrogen bond donor(s) and 6 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 11780218?
The CAS number of BAS 11780218 is 876895-17-9.
What is the molecular formula of BAS 11780218?
The molecular formula of BAS 11780218 is C21H15N3O6.
What is the molecular weight of BAS 11780218?
The molecular weight of BAS 11780218 is 405.10 g/mol.
Where can I buy BAS 11780218?
You can request a quote for BAS 11780218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11780218?
Yes, KEHONG BIO provides custom synthesis services for BAS 11780218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.