Chenyltaurine
TL;DR: Chenyltaurine (CAS 516-35-8) is a chemical compound with molecular formula C26H45NO6S and molecular weight 499.29675 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoylamino]ethanesulfonic acid
Also Known As: Chenyltaurine, Taurochenodeoxycholate, Chenodeoxycholyltaurine, Taurine chenodeoxycholate, TAUROCHENODEOXYCHOLIC ACID
Technical Specifications
| Molecular Formula | C26H45NO6S |
| Molecular Weight | 499.29675 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.29675 Da |
| Heavy Atoms | 34 |
| Complexity | 858.0 |
| SMILES | CC(CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
| InChIKey | BHTRKEVKTKCXOH-XZWNYQJKSA-N |
Product Description
Applications: Chenyltaurine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Chenyltaurine is a fine chemical identified by CAS number 516-35-8 and the molecular formula C26H45NO6S and a molecular weight of 499.3 g/mol. Synonyms include Chenyltaurine and Taurochenodeoxycholate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Chenyltaurine
Property Insights of Chenyltaurine
The XLogP value of 3.6 indicates that Chenyltaurine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Chenyltaurine. Following Lipinski's Rule of Five, Chenyltaurine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chenyltaurine?
The CAS number of Chenyltaurine is 516-35-8.
What is the molecular formula of Chenyltaurine?
The molecular formula of Chenyltaurine is C26H45NO6S.
What is the molecular weight of Chenyltaurine?
The molecular weight of Chenyltaurine is 499.29675 g/mol.
What are the applications of Chenyltaurine?
Chenyltaurine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy Chenyltaurine?
You can request a quote for Chenyltaurine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chenyltaurine?
Yes, CoreyChem provides custom synthesis services for Chenyltaurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.