ChemDiv3_007119
TL;DR: ChemDiv3_007119 (CAS 354553-05-2) is a chemical compound with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-7-methyl-5-oxo-4-pyridin-3-yl-4H-pyrano[3,2-c]pyran-3-carboxylate
Also Known As: ChemDiv3_007119, IDI1_025029, AM-807/12426183, BRD-A63644546-001-01-5, F1765-0087
| Molecular Formula | C16H14N2O5 |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.09027 |
| Heavy Atoms | 23 |
| Complexity | 647.0 |
Chemical Identifiers
| CAS Number | 354553-05-2 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CN=CC=C3)C(=O)O1 |
| InChIKey | MACREFQZRUDUIG-UHFFFAOYSA-N |
Product Overview
ChemDiv3_007119 (CAS 354553-05-2), with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol. IUPAC: methyl 2-amino-7-methyl-5-oxo-4-pyridin-3-yl-4H-pyrano[3,2-c]pyran-3-carboxylate.
Chemical Property Profile of ChemDiv3_007119
Property Insights of ChemDiv3_007119
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_007119. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_007119. Following Lipinski's Rule of Five, ChemDiv3_007119 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 ChemDiv3_007119?
The CAS number of ChemDiv3_007119 is 354553-05-2.
What is the molecular formula of ChemDiv3_007119?
The molecular formula of ChemDiv3_007119 is C16H14N2O5.
What is the molecular weight of ChemDiv3_007119?
The molecular weight of ChemDiv3_007119 is 314.09 g/mol.
Where can I buy ChemDiv3_007119?
You can request a quote for ChemDiv3_007119 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007119?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007119 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.