Biotinylphenylalanylchloromethane
TL;DR: Biotinylphenylalanylchloromethane (CAS 142009-30-1) is a chemical compound with molecular formula C20H26ClN3O3S and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[(2R)-4-chloro-3-oxo-1-phenylbutan-2-yl]pentanamide
Also Known As: Biotinylphenylalanylchloromethane, 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[(2R)-4-chloro-3-oxo-1-phenylbutan-2-yl]pentanamide, 1H-Thieno(3,4-d)imidazole-4-pentanamide, N-(3-chloro-2-oxo-1-(phenylmethyl)propyl)hexahydro-2-oxo-, (3aS-(3aalpha,4beta(R*),6aalpha))-, 1H-Thieno[3,4-d]imidazole-4-pentanamide,N-[3-chloro-2-oxo-1-(phenylmethyl)propyl]hexahydro-2-oxo-,[3aS-[3a,4(R*),6a]]-(9CI), N-(4-Chloro-3-oxo-1-phenylbutan-2-yl)-5-(2-hydroxy-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl)pentanimidic acid
| Molecular Formula | C20H26ClN3O3S |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 423.13834 |
| Heavy Atoms | 28 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 142009-30-1 |
|---|---|
| SMILES | C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)N[C@H](CC3=CC=CC=C3)C(=O)CCl)NC(=O)N2 |
| InChIKey | GHRQVNADRFWTHC-YEWFCNIMSA-N |
Product Overview
Biotinylphenylalanylchloromethane (CAS 142009-30-1), with molecular formula C20H26ClN3O3S and molecular weight 423.14 g/mol. IUPAC: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[(2R)-4-chloro-3-oxo-1-phenylbutan-2-yl]pentanamide.
Chemical Property Profile of Biotinylphenylalanylchloromethane
Property Insights of Biotinylphenylalanylchloromethane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Biotinylphenylalanylchloromethane. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Biotinylphenylalanylchloromethane. Following Lipinski's Rule of Five, Biotinylphenylalanylchloromethane has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Biotinylphenylalanylchloromethane?
The CAS number of Biotinylphenylalanylchloromethane is 142009-30-1.
What is the molecular formula of Biotinylphenylalanylchloromethane?
The molecular formula of Biotinylphenylalanylchloromethane is C20H26ClN3O3S.
What is the molecular weight of Biotinylphenylalanylchloromethane?
The molecular weight of Biotinylphenylalanylchloromethane is 423.14 g/mol.
Where can I buy Biotinylphenylalanylchloromethane?
You can request a quote for Biotinylphenylalanylchloromethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biotinylphenylalanylchloromethane?
Yes, KEHONG BIO provides custom synthesis services for Biotinylphenylalanylchloromethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.