PhCONHEt(Ph)P(O)(OH)PheValValNH2
TL;DR: PhCONHEt(Ph)P(O)(OH)PheValValNH2 (CAS 129318-24-7) is a chemical compound with molecular formula C35H45N4O6P and molecular weight 648.3077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[[(2S)-1-[[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-benzyl-3-oxopropyl]-(1-benzamido-2-phenylethyl)phosphinic acid
Also Known As: PhCONHEt(Ph)P(O)(OH)PheValValNH2, 3,5-dibromo-t-butylbenzene, BenzoylaminodecarboxyPhe-phosphinicodiyl-deaminoPhe-Val-Valineamide, L-Valinamide, N-(2-(((1-(benzoylamino)-2-phenylethyl)hydroxyphosphinyl)methyl)-1-oxo-3-phenylpropyl)-L-valyl-, [3-[[(2S)-1-[[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-benzyl-3-oxopropyl]-(1-benzamido-2-phenylethyl)phosphinic acid
Technical Specifications
| Molecular Formula | C35H45N4O6P |
| Molecular Weight | 648.3077 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 648.3077 Da |
| Heavy Atoms | 46 |
| Complexity | 1050.0 |
| SMILES | CC(C)[C@@H](C(=O)N)NC(=O)[C@H](C(C)C)NC(=O)C(CC1=CC=CC=C1)CP(=O)(C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)O |
| InChIKey | LIENTGAUXNCIDX-NPYONTDKSA-N |
Chemical Property Profile of PhCONHEt(Ph)P(O)(OH)PheValValNH2
Property Insights of PhCONHEt(Ph)P(O)(OH)PheValValNH2
The XLogP value of 4.2 indicates that PhCONHEt(Ph)P(O)(OH)PheValValNH2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 168.0 Ų indicates high polarity, suggesting PhCONHEt(Ph)P(O)(OH)PheValValNH2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PhCONHEt(Ph)P(O)(OH)PheValValNH2 has 5 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 PhCONHEt(Ph)P(O)(OH)PheValValNH2?
The CAS number of PhCONHEt(Ph)P(O)(OH)PheValValNH2 is 129318-24-7.
What is the molecular formula of PhCONHEt(Ph)P(O)(OH)PheValValNH2?
The molecular formula of PhCONHEt(Ph)P(O)(OH)PheValValNH2 is C35H45N4O6P.
What is the molecular weight of PhCONHEt(Ph)P(O)(OH)PheValValNH2?
The molecular weight of PhCONHEt(Ph)P(O)(OH)PheValValNH2 is 648.3077 g/mol.
Where can I buy PhCONHEt(Ph)P(O)(OH)PheValValNH2?
You can request a quote for PhCONHEt(Ph)P(O)(OH)PheValValNH2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PhCONHEt(Ph)P(O)(OH)PheValValNH2?
Yes, CoreyChem provides custom synthesis services for PhCONHEt(Ph)P(O)(OH)PheValValNH2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.