Boc-CH2Ph-NHBn deriv.
TL;DR: Boc-CH2Ph-NHBn deriv. (CAS 126409-25-4) is a chemical compound with molecular formula C30H36N2O4 and molecular weight 488.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-[(2S,3S,5R)-5-benzyl-6-(benzylamino)-3-hydroxy-6-oxo-1-phenylhexan-2-yl]carbamate
Also Known As: Boc-CH2Ph-NHBn deriv., Carbamic acid, ((1S,2S,4R)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)-5-((phenylmethyl)amino)pentyl)-, 1,1-dimethylethyl ester, N-t-Butyloxycarbonyl-5-amino-1,6-diphenyl-4-hydroxy-2-(N-benzylcarbamoyl)hexane, isopropyl N-[(1S,2S,4R)-1,4-dibenzyl-5-(benzylamino)-2-hydroxy-5-oxo-pentyl]carbamate, Carbamic acid, [(1S,2S,4R)-2-hydroxy-5-oxo-1,4-bis(phenylmethyl)-5-[(phenylmethyl)amino]pentyl]-, 1,1-dimethylethyl ester
| Molecular Formula | C30H36N2O4 |
|---|---|
| Molecular Weight | 488.27 g/mol |
| LogP | 4.6586 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 488.26752 |
| Heavy Atoms | 36 |
| Complexity | 1058.0815 |
Chemical Identifiers
| CAS Number | 126409-25-4 |
|---|---|
| SMILES | CC(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)O |
Product Overview
Boc-CH2Ph-NHBn deriv. (CAS 126409-25-4), with molecular formula C30H36N2O4 and molecular weight 488.27 g/mol. IUPAC: propan-2-yl N-[(2S,3S,5R)-5-benzyl-6-(benzylamino)-3-hydroxy-6-oxo-1-phenylhexan-2-yl]carbamate.
Chemical Property Profile of Boc-CH2Ph-NHBn deriv.
Property Insights of Boc-CH2Ph-NHBn deriv.
The XLogP value of 4.6586 indicates that Boc-CH2Ph-NHBn deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-CH2Ph-NHBn deriv.. Following Lipinski's Rule of Five, Boc-CH2Ph-NHBn deriv. has 3 hydrogen bond donor(s) and 4 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 Boc-CH2Ph-NHBn deriv.?
The CAS number of Boc-CH2Ph-NHBn deriv. is 126409-25-4.
What is the molecular formula of Boc-CH2Ph-NHBn deriv.?
The molecular formula of Boc-CH2Ph-NHBn deriv. is C30H36N2O4.
What is the molecular weight of Boc-CH2Ph-NHBn deriv.?
The molecular weight of Boc-CH2Ph-NHBn deriv. is 488.27 g/mol.
Where can I buy Boc-CH2Ph-NHBn deriv.?
You can request a quote for Boc-CH2Ph-NHBn deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-CH2Ph-NHBn deriv.?
Yes, KEHONG BIO provides custom synthesis services for Boc-CH2Ph-NHBn deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.