ChemDiv2_005166
TL;DR: ChemDiv2_005166 (CAS 899380-38-2) is a chemical compound with molecular formula C20H25N3O2 and molecular weight 339.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[butyl(methyl)amino]-8-(furan-2-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: ChemDiv2_005166, IDI1_003881, 6-(butyl(methyl)amino)-8-(furan-2-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 6-[butyl(methyl)amino]-8-(furan-2-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 6-[butyl(methyl)amino]-8-(furan-2-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C20H25N3O2 |
|---|---|
| Molecular Weight | 339.19 g/mol |
| LogP | 4.30088 |
| Topological Polar Surface Area | 62.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.19467 |
| Heavy Atoms | 25 |
| Complexity | 788.258 |
Chemical Identifiers
| CAS Number | 899380-38-2 |
|---|---|
| SMILES | CCCCN(C)C1=C(C2=C(COC(C2)(C)C)C(=N1)C3=CC=CO3)C#N |
Product Overview
ChemDiv2_005166 (CAS 899380-38-2), with molecular formula C20H25N3O2 and molecular weight 339.19 g/mol. IUPAC: 6-[butyl(methyl)amino]-8-(furan-2-yl)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of ChemDiv2_005166
Property Insights of ChemDiv2_005166
The XLogP value of 4.30088 indicates that ChemDiv2_005166 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.29 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_005166. Following Lipinski's Rule of Five, ChemDiv2_005166 has 0 hydrogen bond donor(s) and 5 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 ChemDiv2_005166?
The CAS number of ChemDiv2_005166 is 899380-38-2.
What is the molecular formula of ChemDiv2_005166?
The molecular formula of ChemDiv2_005166 is C20H25N3O2.
What is the molecular weight of ChemDiv2_005166?
The molecular weight of ChemDiv2_005166 is 339.19 g/mol.
Where can I buy ChemDiv2_005166?
You can request a quote for ChemDiv2_005166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_005166?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_005166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.