Ticolubant
TL;DR: Ticolubant (CAS 154413-61-3) is a chemical compound with molecular formula C23H19Cl2NO3S and molecular weight 459.04626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[6-[(2,6-dichlorophenyl)sulfanylmethyl]-3-(2-phenylethoxy)-2-pyridinyl]prop-2-enoic acid
Also Known As: ticolubantum, Ticolubant [USAN:INN], LTB4 antagonist, SB, TICOLUBANT [INN], Ticolubant (USAN/INN)
Technical Specifications
| Molecular Formula | C23H19Cl2NO3S |
| Molecular Weight | 459.04626 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 84.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.04626 Da |
| Heavy Atoms | 30 |
| Complexity | 549.0 |
| SMILES | C1=CC=C(C=C1)CCOC2=C(N=C(C=C2)CSC3=C(C=CC=C3Cl)Cl)/C=C/C(=O)O |
| InChIKey | ZJLFOOWTDISDIO-ZRDIBKRKSA-N |
Chemical Property Profile of Ticolubant
Property Insights of Ticolubant
The XLogP value of 6.1 indicates that Ticolubant is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ticolubant. Following Lipinski's Rule of Five, Ticolubant has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ticolubant?
The CAS number of Ticolubant is 154413-61-3.
What is the molecular formula of Ticolubant?
The molecular formula of Ticolubant is C23H19Cl2NO3S.
What is the molecular weight of Ticolubant?
The molecular weight of Ticolubant is 459.04626 g/mol.
Where can I buy Ticolubant?
You can request a quote for Ticolubant directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ticolubant?
Yes, CoreyChem provides custom synthesis services for Ticolubant and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.