DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-
TL;DR: DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- (CAS 61454-07-7) is a chemical compound with molecular formula C17H21Br2NO5 and molecular weight 476.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2R)-2-(3-bromopropanoylamino)-3-(3-bromopropanoyloxy)-3-phenylpropanoate
Also Known As: DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-, threo-beta-(3-Bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-DL-phenylalanine ethyl ester, 3-Bromo-N-{1-[(3-bromopropanoyl)oxy]-3-ethoxy-3-oxo-1-phenylpropan-2-yl}propanimidic acid, ethyl (2R)-2-(3-bromopropanoylamino)-3-(3-bromopropanoyloxy)-3-phenylpropanoate, 3-Bromo-N-{(2R)-1-[(3-bromopropanoyl)oxy]-3-ethoxy-3-oxo-1-phenylpropan-2-yl}propanimidic acid
| Molecular Formula | C17H21Br2NO5 |
|---|---|
| Molecular Weight | 476.98 g/mol |
| LogP | 2.8888 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 476.97864 |
| Heavy Atoms | 25 |
| Complexity | 567.41644 |
Chemical Identifiers
| CAS Number | 61454-07-7 |
|---|---|
| SMILES | CCOC(=O)[C@@H](C(C1=CC=CC=C1)OC(=O)CCBr)NC(=O)CCBr |
Product Overview
DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- (CAS 61454-07-7), with molecular formula C17H21Br2NO5 and molecular weight 476.98 g/mol. IUPAC: ethyl (2R)-2-(3-bromopropanoylamino)-3-(3-bromopropanoyloxy)-3-phenylpropanoate.
Chemical Property Profile of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-
Property Insights of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-
The XLogP value of 2.8888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-. Following Lipinski's Rule of Five, DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- has 1 hydrogen bond donor(s) and 5 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 DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-?
The CAS number of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- is 61454-07-7.
What is the molecular formula of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-?
The molecular formula of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- is C17H21Br2NO5.
What is the molecular weight of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-?
The molecular weight of DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- is 476.98 g/mol.
Where can I buy DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-?
You can request a quote for DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo-?
Yes, KEHONG BIO provides custom synthesis services for DL-Phenylalanine, beta-(3-bromo-1-oxopropoxy)-N-(3-bromo-1-oxopropyl)-, ethyl ester, threo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.