![2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e structure](/static/products/3086/3086-21-3.webp)
2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e
TL;DR: 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e (CAS 3086-21-3) is a chemical compound with molecular formula C23H16Cl5NO4 and molecular weight 544.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentachlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: pentachlorophenyl n-[(benzyloxy)carbonyl]phenylalaninate, (2,3,4,5,6-pentachlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate, 2,3,4,5,6-pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e
| Molecular Formula | C23H16Cl5NO4 |
|---|---|
| Molecular Weight | 544.95 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 544.9522 |
| Heavy Atoms | 33 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 3086-21-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)NC(=O)OCC3=CC=CC=C3 |
| InChIKey | JMMQXIKTWGCUMQ-UHFFFAOYSA-N |
Product Overview
2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e (CAS 3086-21-3), with molecular formula C23H16Cl5NO4 and molecular weight 544.95 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e
Property Insights of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e
The XLogP value of 8.0 indicates that 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e. Following Lipinski's Rule of Five, 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e?
The CAS number of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e is 3086-21-3.
What is the molecular formula of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e?
The molecular formula of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e is C23H16Cl5NO4.
What is the molecular weight of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e?
The molecular weight of 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e is 544.95 g/mol.
Where can I buy 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e?
You can request a quote for 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5,6-Pentachlorophenyl 3-phenyl-2-[(phenylmethoxy)carbonylamino]propanoat e and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.