Fibracillin
TL;DR: Fibracillin (CAS 51154-48-4) is a chemical compound with molecular formula C26H28ClN3O6S and molecular weight 545.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-6-[[(2R)-2-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Fibracillin, Fibracilina, Fibracilline, Mitibron, Fibracillinum
| Molecular Formula | C26H28ClN3O6S |
|---|---|
| Molecular Weight | 545.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 545.13873 |
| Heavy Atoms | 37 |
| Complexity | 916.0 |
Chemical Identifiers
| CAS Number | 51154-48-4 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)NC(=O)C(C)(C)OC4=CC=C(C=C4)Cl)C(=O)O)C |
| InChIKey | BSIJLJGDLNRGBY-NXWNEQKCSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fibracillin (CAS 51154-48-4), with molecular formula C26H28ClN3O6S and molecular weight 545.14 g/mol. IUPAC: (2S,5R,6R)-6-[[(2R)-2-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Fibracillin
Property Insights of Fibracillin
The XLogP value of 3.8 indicates that Fibracillin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting Fibracillin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Fibracillin has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fibracillin?
The CAS number of Fibracillin is 51154-48-4.
What is the molecular formula of Fibracillin?
The molecular formula of Fibracillin is C26H28ClN3O6S.
What is the molecular weight of Fibracillin?
The molecular weight of Fibracillin is 545.14 g/mol.
Where can I buy Fibracillin?
You can request a quote for Fibracillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fibracillin?
Yes, KEHONG BIO provides custom synthesis services for Fibracillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.