2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester
TL;DR: 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester (CAS 2116-82-7) is a chemical compound with molecular formula C28H29N3O8 and molecular weight 535.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 2,6-bis(phenylmethoxycarbonylamino)hexanoate
Also Known As: Z-Lys(Z)-ONp, I14-5031, (4-nitrophenyl) 2,6-bis(phenylmethoxycarbonylamino)hexanoate, (4-nitrophenyl) 2,6-bis(benzyloxycarbonylamino)hexanoate, (S)-4-Nitrophenyl 2,6-bis(((benzyloxy)carbonyl)amino)hexanoate
| Molecular Formula | C28H29N3O8 |
|---|---|
| Molecular Weight | 535.20 g/mol |
| LogP | 4.8919 |
| Topological Polar Surface Area | 146.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 535.19543 |
| Heavy Atoms | 39 |
| Complexity | 1220.5752 |
Chemical Identifiers
| CAS Number | 2116-82-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NCCCCC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3 |
Product Overview
2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester (CAS 2116-82-7), with molecular formula C28H29N3O8 and molecular weight 535.20 g/mol. IUPAC: (4-nitrophenyl) 2,6-bis(phenylmethoxycarbonylamino)hexanoate.
Chemical Property Profile of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester
Property Insights of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester
The XLogP value of 4.8919 indicates that 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.1 Ų indicates high polarity, suggesting 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester?
The CAS number of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester is 2116-82-7.
What is the molecular formula of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester?
The molecular formula of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester is C28H29N3O8.
What is the molecular weight of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester?
The molecular weight of 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester is 535.20 g/mol.
Where can I buy 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester?
You can request a quote for 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.