N-carbobenzoxy-N-lithocholyl-epsilon-lysine
TL;DR: N-carbobenzoxy-N-lithocholyl-epsilon-lysine (CAS 104211-96-3) is a chemical compound with molecular formula C38H58N2O6 and molecular weight 638.4295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-6-[[(4R)-4-[(3R,5R,10S,13R,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid
Also Known As: Cbz-E-lcl, N-alpha-Cbz-N-epsilon-lithocholyllysine, N-Carbobenzoxy-N-lithocholyl-epsilon-lysine, (2S)-6-[[(4R)-4-[(3R,5R,10S,13R,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid, N~2~-[(Benzyloxy)(hydroxy)methylidene]-N~6~-(3,24-dihydroxycholan-24-ylidene)lysine
Technical Specifications
| Molecular Formula | C38H58N2O6 |
| Molecular Weight | 638.4295 g/mol |
| XLogP | 7.9 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 638.4295 Da |
| Heavy Atoms | 46 |
| Complexity | 1050.0 |
| SMILES | C[C@H](CCC(=O)NCCCC[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1)[C@@H]2CCC3[C@@]2(CCC4C3CC[C@H]5[C@@]4(CC[C@H](C5)O)C)C |
| InChIKey | XIVDICBERWSPRK-TXJNDFRHSA-N |
Chemical Property Profile of N-carbobenzoxy-N-lithocholyl-epsilon-lysine
Property Insights of N-carbobenzoxy-N-lithocholyl-epsilon-lysine
The XLogP value of 7.9 indicates that N-carbobenzoxy-N-lithocholyl-epsilon-lysine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-carbobenzoxy-N-lithocholyl-epsilon-lysine. Following Lipinski's Rule of Five, N-carbobenzoxy-N-lithocholyl-epsilon-lysine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-carbobenzoxy-N-lithocholyl-epsilon-lysine?
The CAS number of N-carbobenzoxy-N-lithocholyl-epsilon-lysine is 104211-96-3.
What is the molecular formula of N-carbobenzoxy-N-lithocholyl-epsilon-lysine?
The molecular formula of N-carbobenzoxy-N-lithocholyl-epsilon-lysine is C38H58N2O6.
What is the molecular weight of N-carbobenzoxy-N-lithocholyl-epsilon-lysine?
The molecular weight of N-carbobenzoxy-N-lithocholyl-epsilon-lysine is 638.4295 g/mol.
Where can I buy N-carbobenzoxy-N-lithocholyl-epsilon-lysine?
You can request a quote for N-carbobenzoxy-N-lithocholyl-epsilon-lysine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-carbobenzoxy-N-lithocholyl-epsilon-lysine?
Yes, CoreyChem provides custom synthesis services for N-carbobenzoxy-N-lithocholyl-epsilon-lysine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.