N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate
TL;DR: N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate (CAS 120841-37-4) is a chemical compound with molecular formula C35H44BN3O2 and molecular weight 549.35266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-aminoacetyl)-(2,2-dimethylpropanoyl)amino]ethyl-ethylazanium;tetraphenylboranuide
Also Known As: Boc-gly-tpb, Buco-gly-gly-psi(CH2-N+H2)nhet.bph(4), N-(tert-Butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate, 2-[(2-aminoacetyl)-(2,2-dimethylpropanoyl)amino]ethyl-ethylazanium;tetraphenylboranuide, 2-(5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid
Technical Specifications
| Molecular Formula | C35H44BN3O2 |
| Molecular Weight | 549.35266 g/mol |
| XLogP | 1.9937 |
| Topological Polar Surface Area (TPSA) | 80.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 549.35266 Da |
| Heavy Atoms | 41 |
| Complexity | 547.0 |
| SMILES | [B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC[NH2+]CCN(C(=O)CN)C(=O)C(C)(C)C |
| InChIKey | ZFIUPJHPIXVPOQ-UHFFFAOYSA-O |
Chemical Property Profile of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate
Property Insights of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate
The XLogP value of 1.9937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate. Following Lipinski's Rule of Five, N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate?
The CAS number of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate is 120841-37-4.
What is the molecular formula of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate?
The molecular formula of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate is C35H44BN3O2.
What is the molecular weight of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate?
The molecular weight of N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate is 549.35266 g/mol.
Where can I buy N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate?
You can request a quote for N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate?
Yes, CoreyChem provides custom synthesis services for N-(tert-butylcarbonylglycylaminoethyl)-N-(ethyl)ammonium tetraphenylborate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.