(S)-N-(Butoxycarbonyl)-4-aminophenylalaninol
TL;DR: (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol (CAS 188404-34-4) is a chemical compound with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-[(2S)-1-(4-aminophenyl)-3-hydroxypropan-2-yl]carbamate
Also Known As: (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol, 404B344, butyl N-[(2S)-1-(4-aminophenyl)-3-hydroxypropan-2-yl]carbamate
| Molecular Formula | C14H22N2O3 |
|---|---|
| Molecular Weight | 266.16 g/mol |
| LogP | 1.6985 |
| Topological Polar Surface Area | 84.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 266.16306 |
| Heavy Atoms | 19 |
| Complexity | 378.7824 |
Chemical Identifiers
| CAS Number | 188404-34-4 |
|---|---|
| SMILES | CCCCOC(=O)N[C@@H](CC1=CC=C(C=C1)N)CO |
Product Overview
(S)-N-(Butoxycarbonyl)-4-aminophenylalaninol (CAS 188404-34-4), with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol. IUPAC: butyl N-[(2S)-1-(4-aminophenyl)-3-hydroxypropan-2-yl]carbamate.
Chemical Property Profile of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol
Property Insights of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol
The XLogP value of 1.6985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol. The TPSA of 84.58 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol. Following Lipinski's Rule of Five, (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol 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 (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol?
The CAS number of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol is 188404-34-4.
What is the molecular formula of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol?
The molecular formula of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol is C14H22N2O3.
What is the molecular weight of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol?
The molecular weight of (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol is 266.16 g/mol.
Where can I buy (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol?
You can request a quote for (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol?
Yes, KEHONG BIO provides custom synthesis services for (S)-N-(Butoxycarbonyl)-4-aminophenylalaninol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.