BAS 01107906
TL;DR: BAS 01107906 (CAS 309926-41-8) is a chemical compound with molecular formula C16H10ClN3O5 and molecular weight 359.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile
Also Known As: BAS 01107906, 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile, A0371/0017076
| Molecular Formula | C16H10ClN3O5 |
|---|---|
| Molecular Weight | 359.03 g/mol |
| LogP | 2.728 |
| Topological Polar Surface Area | 132.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.03088 |
| Heavy Atoms | 25 |
| Complexity | 1035.0413 |
Chemical Identifiers
| CAS Number | 309926-41-8 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)O1 |
Product Overview
BAS 01107906 (CAS 309926-41-8), with molecular formula C16H10ClN3O5 and molecular weight 359.03 g/mol. IUPAC: 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile.
Chemical Property Profile of BAS 01107906
Property Insights of BAS 01107906
The XLogP value of 2.728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01107906. The TPSA of 132.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01107906. Following Lipinski's Rule of Five, BAS 01107906 has 1 hydrogen bond donor(s) and 7 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 01107906?
The CAS number of BAS 01107906 is 309926-41-8.
What is the molecular formula of BAS 01107906?
The molecular formula of BAS 01107906 is C16H10ClN3O5.
What is the molecular weight of BAS 01107906?
The molecular weight of BAS 01107906 is 359.03 g/mol.
Where can I buy BAS 01107906?
You can request a quote for BAS 01107906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01107906?
Yes, KEHONG BIO provides custom synthesis services for BAS 01107906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.