泛硫乙胺
TL;DR: 泛硫乙胺 (CAS 16816-67-4) is a chemical compound with molecular formula C22H42N4O8S2 and molecular weight 554.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
泛硫乙胺
N-[3-[2-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]-2,4-dihydroxy-3,3-dimethylbutanamide
Also Known As: pantethine, D-Pantethine, Bis-pantethine, panthecin, Dermorizin
| Molecular Formula | C22H42N4O8S2 |
|---|---|
| Molecular Weight | 554.24 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 19 |
| Exact Mass | 554.2444 |
| Heavy Atoms | 36 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 16816-67-4 |
|---|---|
| SMILES | CC(C)(CO)C(C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)C(C(C)(C)CO)O)O |
| InChIKey | DJWYOLJPSHDSAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
泛硫乙胺 (CAS 16816-67-4), with molecular formula C22H42N4O8S2 and molecular weight 554.24 g/mol. IUPAC: N-[3-[2-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]-2,4-dihydroxy-3,3-dimethylbutanamide.
Chemical Property Profile of 泛硫乙胺
Property Insights of 泛硫乙胺
The XLogP value of -2.2 indicates that 泛硫乙胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.0 Ų indicates high polarity, suggesting 泛硫乙胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 二硫二泛酸 has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二硫二泛酸?
The CAS number of 二硫二泛酸 is 16816-67-4.
What is the molecular formula of 二硫二泛酸?
The molecular formula of 二硫二泛酸 is C22H42N4O8S2.
What is the molecular weight of 二硫二泛酸?
The molecular weight of 二硫二泛酸 is 554.24 g/mol.
Where can I buy 二硫二泛酸?
You can request a quote for 二硫二泛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二硫二泛酸?
Yes, KEHONG BIO provides custom synthesis services for 二硫二泛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.