TimTec1_003002
TL;DR: TimTec1_003002 (CAS 239789-47-0) is a chemical compound with molecular formula C14H18O5 and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(oxolan-2-ylmethoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: TimTec1_003002, 3-[(tetrahydro-2-furanylmethoxy)carbonyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, AN-329/13631571, 3-(oxolan-2-ylmethoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[(oxolan-2-ylmethyl)oxycarbonyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
| Molecular Formula | C14H18O5 |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 1.2315 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.11542 |
| Heavy Atoms | 19 |
| Complexity | 410.0594 |
Chemical Identifiers
| CAS Number | 239789-47-0 |
|---|---|
| SMILES | C1CC(OC1)COC(=O)C2C3CC(C2C(=O)O)C=C3 |
Product Overview
TimTec1_003002 (CAS 239789-47-0), with molecular formula C14H18O5 and molecular weight 266.12 g/mol. IUPAC: 3-(oxolan-2-ylmethoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of TimTec1_003002
Property Insights of TimTec1_003002
The XLogP value of 1.2315 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_003002. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_003002. Following Lipinski's Rule of Five, TimTec1_003002 has 1 hydrogen bond donor(s) and 4 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 TimTec1_003002?
The CAS number of TimTec1_003002 is 239789-47-0.
What is the molecular formula of TimTec1_003002?
The molecular formula of TimTec1_003002 is C14H18O5.
What is the molecular weight of TimTec1_003002?
The molecular weight of TimTec1_003002 is 266.12 g/mol.
Where can I buy TimTec1_003002?
You can request a quote for TimTec1_003002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_003002?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_003002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.