N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester
TL;DR: N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester (CAS 142181-99-5) is a chemical compound with molecular formula C14H22N4O3 and molecular weight 294.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-(4-aminobutyl)-N-(dimethylcarbamoylamino)carbamate
Also Known As: Nndcalp, N - alpha-azalysinephenylester, N(alpha)-(N,N-Dimethylcarbamoyl)alpha-azalysine phenyl ester, N2-(N,N-Dimethylcarbamoyl)-2-azalysine phenyl ester, phenyl N-(4-aminobutyl)-N-(dimethylcarbamoylamino)carbamate
| Molecular Formula | C14H22N4O3 |
|---|---|
| Molecular Weight | 294.17 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 294.1692 |
| Heavy Atoms | 21 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 142181-99-5 |
|---|---|
| SMILES | CN(C)C(=O)NN(CCCCN)C(=O)OC1=CC=CC=C1 |
| InChIKey | IWDCXKZHWTWLEE-UHFFFAOYSA-N |
Product Overview
N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester (CAS 142181-99-5), with molecular formula C14H22N4O3 and molecular weight 294.17 g/mol. IUPAC: phenyl N-(4-aminobutyl)-N-(dimethylcarbamoylamino)carbamate.
Chemical Property Profile of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester
Property Insights of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester. Following Lipinski's Rule of Five, N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester has 2 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 N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester?
The CAS number of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester is 142181-99-5.
What is the molecular formula of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester?
The molecular formula of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester is C14H22N4O3.
What is the molecular weight of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester?
The molecular weight of N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester is 294.17 g/mol.
Where can I buy N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester?
You can request a quote for N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for N(alpha)-(N,N-dimethylcarbamoyl)alpha-azalysine phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.