Lecimibide
TL;DR: Lecimibide (CAS 130804-35-2) is a chemical compound with molecular formula C34H40F2N4OS and molecular weight 590.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-difluorophenyl)-1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptylurea
Also Known As: Lecimibide, lecimibida, lecimibidum, dup128, DuP 128
| Molecular Formula | C34H40F2N4OS |
|---|---|
| Molecular Weight | 590.29 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 590.28906 |
| Heavy Atoms | 42 |
| Complexity | 751.0 |
Chemical Identifiers
| CAS Number | 130804-35-2 |
|---|---|
| SMILES | CCCCCCCN(CCCCCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)F |
| InChIKey | TVXOXGBTADZYCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lecimibide (CAS 130804-35-2), with molecular formula C34H40F2N4OS and molecular weight 590.29 g/mol. IUPAC: 3-(2,4-difluorophenyl)-1-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentyl]-1-heptylurea.
Chemical Property Profile of Lecimibide
Property Insights of Lecimibide
The XLogP value of 9.3 indicates that Lecimibide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Lecimibide. Following Lipinski's Rule of Five, Lecimibide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lecimibide?
The CAS number of Lecimibide is 130804-35-2.
What is the molecular formula of Lecimibide?
The molecular formula of Lecimibide is C34H40F2N4OS.
What is the molecular weight of Lecimibide?
The molecular weight of Lecimibide is 590.29 g/mol.
Where can I buy Lecimibide?
You can request a quote for Lecimibide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lecimibide?
Yes, KEHONG BIO provides custom synthesis services for Lecimibide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.