H4 SALEN
TL;DR: H4 SALEN (CAS 186537-85-9) is a chemical compound with molecular formula C28H37N3O5S and molecular weight 527.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
Also Known As: H4 SALEN, Je 533, 4-Thiazolidinecarboxamide, N-(1,1-dimethylethyl)-3-((2S,3S)-2-hydroxy-3-((3-hydroxy-2-methylbenzoyl)amino)-1-oxo-4-phenylbutyl)-5,5-dimethyl-,(4R)-, (4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide, (4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylphenyl)formamido]-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
| Molecular Formula | C28H37N3O5S |
|---|---|
| Molecular Weight | 527.25 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 527.2454 |
| Heavy Atoms | 37 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 186537-85-9 |
|---|---|
| SMILES | CC1=C(C=CC=C1O)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](C(=O)N3CSC([C@H]3C(=O)NC(C)(C)C)(C)C)O |
| InChIKey | CGFVYUGIPISJQG-ACIOBRDBSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
H4 SALEN (CAS 186537-85-9), with molecular formula C28H37N3O5S and molecular weight 527.25 g/mol. IUPAC: (4R)-N-tert-butyl-3-[(2S,3S)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide.
Chemical Property Profile of H4 SALEN
Property Insights of H4 SALEN
The XLogP value of 3.6 indicates that H4 SALEN is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting H4 SALEN may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H4 SALEN has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of H4 SALEN?
The CAS number of H4 SALEN is 186537-85-9.
What is the molecular formula of H4 SALEN?
The molecular formula of H4 SALEN is C28H37N3O5S.
What is the molecular weight of H4 SALEN?
The molecular weight of H4 SALEN is 527.25 g/mol.
Where can I buy H4 SALEN?
You can request a quote for H4 SALEN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for H4 SALEN?
Yes, KEHONG BIO provides custom synthesis services for H4 SALEN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.