![N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide structure](/static/products/304/304645-59-8.png)
N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
TL;DR: N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide (CAS 304645-59-8) is a chemical compound with molecular formula C27H27ClN2O2 and molecular weight 446.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[4-(3-chloro-1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
Also Known As: F0340-0002, (2E)-N-[4-(3-chloroadamantanyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enami de, (E)-N-[4-(3-chloro-1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide, N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide, (E)-N-(4-((1r,3s,5R,7S)-3-chloroadamantan-1-yl)phenyl)-2-cyano-3-(4-methoxyphenyl)acrylamide
| Molecular Formula | C27H27ClN2O2 |
|---|---|
| Molecular Weight | 446.18 g/mol |
| LogP | 6.07008 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.17612 |
| Heavy Atoms | 32 |
| Complexity | 1083.9714 |
Chemical Identifiers
| CAS Number | 304645-59-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)(C4)Cl |
Product Overview
N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide (CAS 304645-59-8), with molecular formula C27H27ClN2O2 and molecular weight 446.18 g/mol. IUPAC: (E)-N-[4-(3-chloro-1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
Property Insights of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide
The XLogP value of 6.07008 indicates that N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide?
The CAS number of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide is 304645-59-8.
What is the molecular formula of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide?
The molecular formula of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide is C27H27ClN2O2.
What is the molecular weight of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide?
The molecular weight of N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide is 446.18 g/mol.
Where can I buy N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide?
You can request a quote for N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(3-chloroadamantan-1-yl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.