S-18326
TL;DR: S-18326 (CAS 167843-21-2) is a chemical compound with molecular formula C23H37BN6O5 and molecular weight 488.29184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1R)-1-[[2-[[(2R)-2-acetamido-3-phenylpropanoyl]-cyclopentylamino]acetyl]amino]-4-(diaminomethylideneamino)butyl]boronic acid
Also Known As: S-18326, J1.678.046D, S 18326, [(1R)-4-carbamimidamido-1-{2-[(2R)-N-cyclopentyl-2-acetamido-3-phenylpropanamido]acetamido}butyl]boronic acid, N-[(1R)-4-[(Aminoiminomethyl)amino]-1-boronobutyl]-N2-(N-acetyl-D-phenylalanyl)-N2-cyclopentylglycinamide
Technical Specifications
| Molecular Formula | C23H37BN6O5 |
| Molecular Weight | 488.29184 g/mol |
| XLogP | -0.9446 |
| Topological Polar Surface Area (TPSA) | 183.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 488.29184 Da |
| Heavy Atoms | 35 |
| Complexity | 721.0 |
| SMILES | B([C@H](CCCN=C(N)N)NC(=O)CN(C1CCCC1)C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C)(O)O |
| InChIKey | XSHCQGJMSFRKKN-UXHICEINSA-N |
Chemical Property Profile of S-18326
Property Insights of S-18326
The XLogP value of -0.9446 indicates that S-18326 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 183.0 Ų indicates high polarity, suggesting S-18326 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-18326 has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of S-18326?
The CAS number of S-18326 is 167843-21-2.
What is the molecular formula of S-18326?
The molecular formula of S-18326 is C23H37BN6O5.
What is the molecular weight of S-18326?
The molecular weight of S-18326 is 488.29184 g/mol.
Where can I buy S-18326?
You can request a quote for S-18326 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S-18326?
Yes, CoreyChem provides custom synthesis services for S-18326 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.