Foropafant fumarate
TL;DR: Foropafant fumarate (CAS 136470-45-6) is a chemical compound with molecular formula C32H44N4O4S and molecular weight 580.30835 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;N,N-dimethyl-N'-(pyridin-3-ylmethyl)-N'-[4-[2,4,6-tri(propan-2-yl)phenyl]-1,3-thiazol-2-yl]ethane-1,2-diamine
Also Known As: Foropafant fumarate, SR 27417A, 1,2-Ethanediamine, N,N-dimethyl-N'-(3-pyridinylmethyl)-N'-(4-(2,4,6-tris(1-methylethyl)phenyl)-2-thiazolyl)-, (2E)-2-butenedioate (1:1), 1,2-ETHANEDIAMINE, N1,N1-DIMETHYL-N2-(3-PYRIDINYLMETHYL)-N2-(4-(2,4,6-TRIS(1-METHYLETHYL)PHENYL)-2-THIAZOLYL)-, (2E)-2-BUTENEDIOATE (1:1)
Technical Specifications
| Molecular Formula | C32H44N4O4S |
| Molecular Weight | 580.30835 g/mol |
| XLogP | 6.8553 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 580.30835 Da |
| Heavy Atoms | 41 |
| Complexity | 667.0 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)C)C2=CSC(=N2)N(CCN(C)C)CC3=CN=CC=C3)C(C)C.C(=C/C(=O)O)\C(=O)O |
| InChIKey | VVMIAYBAROQMMT-WLHGVMLRSA-N |
Chemical Property Profile of Foropafant fumarate
Property Insights of Foropafant fumarate
The XLogP value of 6.8553 indicates that Foropafant fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Foropafant fumarate. Following Lipinski's Rule of Five, Foropafant fumarate has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Foropafant fumarate?
The CAS number of Foropafant fumarate is 136470-45-6.
What is the molecular formula of Foropafant fumarate?
The molecular formula of Foropafant fumarate is C32H44N4O4S.
What is the molecular weight of Foropafant fumarate?
The molecular weight of Foropafant fumarate is 580.30835 g/mol.
Where can I buy Foropafant fumarate?
You can request a quote for Foropafant fumarate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Foropafant fumarate?
Yes, CoreyChem provides custom synthesis services for Foropafant fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.