C14-H20-N2-O2
TL;DR: C14-H20-N2-O2 (CAS 89246-53-7) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethanimidoyl-2-ethyl-1-hydroxy-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-3-one
Also Known As: 2,5,6,7,8,9-Hexahydro-2-ethyl-3-hydroxy-4-(1-iminoethyl)-1H-cyclohepta(c)pyridin-1-one, 1H-Cyclohepta(c)pyridin-1-one, 2,5,6,7,8,9-hexahydro-2-ethyl-3-hydroxy-4-(1-iminoethyl)-, (4Z)-4-(1-aminoethylidene)-2-ethyl-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridine-1,3-dione, 1H-CYCLOHEPTA(c)PYRIDIN-1-ONE, 2,5,6,7,8,9-HEXAHYDRO-2-ETHYL-3-HYDROXY-4-(1-IMIN
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 89246-53-7 |
|---|---|
| SMILES | CCN1C(=C2CCCCCC2=C(C1=O)C(=N)C)O |
| InChIKey | HWMQUYSFCXZMIB-UHFFFAOYSA-N |
Product Overview
C14-H20-N2-O2 (CAS 89246-53-7), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: 4-ethanimidoyl-2-ethyl-1-hydroxy-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-3-one.
Chemical Property Profile of C14-H20-N2-O2
Property Insights of C14-H20-N2-O2
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14-H20-N2-O2. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for C14-H20-N2-O2. Following Lipinski's Rule of Five, C14-H20-N2-O2 has 2 hydrogen bond donor(s) and 3 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 C14-H20-N2-O2?
The CAS number of C14-H20-N2-O2 is 89246-53-7.
What is the molecular formula of C14-H20-N2-O2?
The molecular formula of C14-H20-N2-O2 is C14H20N2O2.
What is the molecular weight of C14-H20-N2-O2?
The molecular weight of C14-H20-N2-O2 is 248.15 g/mol.
Where can I buy C14-H20-N2-O2?
You can request a quote for C14-H20-N2-O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14-H20-N2-O2?
Yes, KEHONG BIO provides custom synthesis services for C14-H20-N2-O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.