TimTec1_004475
TL;DR: TimTec1_004475 (CAS 355403-83-7) is a chemical compound with molecular formula C19H23NO5 and molecular weight 345.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: TimTec1_004475, BAS 00821008, 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid, 3-((3,4-dimethoxyphenethyl)carbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
| Molecular Formula | C19H23NO5 |
|---|---|
| Molecular Weight | 345.16 g/mol |
| LogP | 1.8854 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.15762 |
| Heavy Atoms | 25 |
| Complexity | 699.05493 |
Chemical Identifiers
| CAS Number | 355403-83-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2C3CC(C2C(=O)O)C=C3)OC |
Product Overview
TimTec1_004475 (CAS 355403-83-7), with molecular formula C19H23NO5 and molecular weight 345.16 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of TimTec1_004475
Property Insights of TimTec1_004475
The XLogP value of 1.8854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_004475. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_004475. Following Lipinski's Rule of Five, TimTec1_004475 has 2 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_004475?
The CAS number of TimTec1_004475 is 355403-83-7.
What is the molecular formula of TimTec1_004475?
The molecular formula of TimTec1_004475 is C19H23NO5.
What is the molecular weight of TimTec1_004475?
The molecular weight of TimTec1_004475 is 345.16 g/mol.
Where can I buy TimTec1_004475?
You can request a quote for TimTec1_004475 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_004475?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_004475 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.