P3CSS
TL;DR: P3CSS (CAS 6277-06-1) is a chemical compound with molecular formula C60H113N3O11S and molecular weight 1083.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[[(2R)-3-[2,3-di(hexadecanoyloxy)propylsulfanyl]-2-(hexadecanoylamino)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoic acid
Also Known As: tripalmitoyl-S-glyceryl-Cys-Ser-Ser, tripalmitoyl-s-glyceryl-cysteinyl-seryl-serine, Tripalmitoyl-S-glycerylcysteinyl-seryl-serine, N-Palmitoyl-5,6-dipalmitoyl-S-glycerylcysteinyl-seryl-serine, s-[2,3-bis(hexadecanoyloxy)propyl]-n-hexadecanoyl-l-cysteinyl-l-seryl-l-serine
| Molecular Formula | C60H113N3O11S |
|---|---|
| Molecular Weight | 1083.81 g/mol |
| LogP | 19.0 |
| Topological Polar Surface Area | 243.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 59 |
| Exact Mass | 1083.8096 |
| Heavy Atoms | 75 |
| Complexity | 1390.0 |
Chemical Identifiers
| CAS Number | 6277-06-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)N[C@@H](CSCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O |
| InChIKey | XVQKZSLOGHBCET-INVHGPFASA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
P3CSS (CAS 6277-06-1), with molecular formula C60H113N3O11S and molecular weight 1083.81 g/mol. IUPAC: (2S)-2-[[(2S)-2-[[(2R)-3-[2,3-di(hexadecanoyloxy)propylsulfanyl]-2-(hexadecanoylamino)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoic acid.
Chemical Property Profile of P3CSS
Property Insights of P3CSS
The XLogP value of 19.0 indicates that P3CSS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 243.0 Ų indicates high polarity, suggesting P3CSS may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, P3CSS has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of P3CSS?
The CAS number of P3CSS is 6277-06-1.
What is the molecular formula of P3CSS?
The molecular formula of P3CSS is C60H113N3O11S.
What is the molecular weight of P3CSS?
The molecular weight of P3CSS is 1083.81 g/mol.
Where can I buy P3CSS?
You can request a quote for P3CSS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for P3CSS?
Yes, KEHONG BIO provides custom synthesis services for P3CSS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.