KT-362 fumarate
TL;DR: KT-362 fumarate (CAS 105394-80-7) is a chemical compound with molecular formula C26H32N2O7S and molecular weight 516.193 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-[2-(3,4-dimethoxyphenyl)ethylamino]propan-1-one
Also Known As: KT-362 fumarate, KT 362, KT 326, but-2-enedioic acid; 3-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(2-thia-6-azabicyclo[5.4.0]undeca-7,9,11-trien-6-yl)propan-1-one, 1,5-Benzothiazepine, 5-[3-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-1-oxopropyl]-2,3,4,5-tetrahydro-, (2E)-2-butenedioate (1:1);1,5-Benzothiazepine, 5-[3-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-1-oxopropyl]-2,3,4,5-tetrahydro-, (2E)-2-butenedioate (1:1)
Technical Specifications
| Molecular Formula | C26H32N2O7S |
| Molecular Weight | 516.193 g/mol |
| XLogP | 3.47 |
| Topological Polar Surface Area (TPSA) | 151.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 516.193 Da |
| Heavy Atoms | 36 |
| Complexity | 598.0 |
| SMILES | COC1=C(C=C(C=C1)CCNCCC(=O)N2CCCSC3=CC=CC=C32)OC.C(=CC(=O)O)C(=O)O |
| InChIKey | YIVXAQUBENUHJC-UHFFFAOYSA-N |
Chemical Property Profile of KT-362 fumarate
Property Insights of KT-362 fumarate
The XLogP value of 3.47 indicates that KT-362 fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting KT-362 fumarate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, KT-362 fumarate has 3 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 KT-362 fumarate?
The CAS number of KT-362 fumarate is 105394-80-7.
What is the molecular formula of KT-362 fumarate?
The molecular formula of KT-362 fumarate is C26H32N2O7S.
What is the molecular weight of KT-362 fumarate?
The molecular weight of KT-362 fumarate is 516.193 g/mol.
Where can I buy KT-362 fumarate?
You can request a quote for KT-362 fumarate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for KT-362 fumarate?
Yes, CoreyChem provides custom synthesis services for KT-362 fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.