Ethyl 4-(4-pyridinylmethyl)phenylcarbamate
TL;DR: Ethyl 4-(4-pyridinylmethyl)phenylcarbamate (CAS 698988-02-2) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[4-(pyridin-4-ylmethyl)phenyl]carbamate
Also Known As: ethyl 4-(4-pyridinylmethyl)phenylcarbamate, ethyl N-[4-(pyridin-4-ylmethyl)phenyl]carbamate, BAS 13091336, ethyl [4-(pyridin-4-ylmethyl)phenyl]carbamate, ethoxy-N-[4-(4-pyridylmethyl)phenyl]carboxamide
| Molecular Formula | C15H16N2O2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 3.2408 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.1212 |
| Heavy Atoms | 19 |
| Complexity | 523.6017 |
Chemical Identifiers
| CAS Number | 698988-02-2 |
|---|---|
| SMILES | CCOC(=O)NC1=CC=C(C=C1)CC2=CC=NC=C2 |
Product Overview
Ethyl 4-(4-pyridinylmethyl)phenylcarbamate (CAS 698988-02-2), with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol. IUPAC: ethyl N-[4-(pyridin-4-ylmethyl)phenyl]carbamate.
Chemical Property Profile of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate
Property Insights of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate
The XLogP value of 3.2408 indicates that Ethyl 4-(4-pyridinylmethyl)phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Ethyl 4-(4-pyridinylmethyl)phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(4-pyridinylmethyl)phenylcarbamate has 1 hydrogen bond donor(s) and 3 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 Ethyl 4-(4-pyridinylmethyl)phenylcarbamate?
The CAS number of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate is 698988-02-2.
What is the molecular formula of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate?
The molecular formula of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate is C15H16N2O2.
What is the molecular weight of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate?
The molecular weight of Ethyl 4-(4-pyridinylmethyl)phenylcarbamate is 256.12 g/mol.
Where can I buy Ethyl 4-(4-pyridinylmethyl)phenylcarbamate?
You can request a quote for Ethyl 4-(4-pyridinylmethyl)phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(4-pyridinylmethyl)phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(4-pyridinylmethyl)phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.