2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide
TL;DR: 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide (CAS 84912-05-0) is a chemical compound with molecular formula C12H23ClN2O and molecular weight 246.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide
Also Known As: EINECS 284-467-8, 2-Chloro-3-(diethylamino)-N,N-diethyl-2-butenamide, 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide, 2-Butenamide,2-chloro-3-(diethylamino)-N,N-diethyl-, 2-Butenamide, 2-chloro-3-(diethylamino)-N,N-diethyl-
| Molecular Formula | C12H23ClN2O |
|---|---|
| Molecular Weight | 246.15 g/mol |
| LogP | 2.6669 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.14989 |
| Heavy Atoms | 16 |
| Complexity | 255.74437 |
Chemical Identifiers
| CAS Number | 84912-05-0 |
|---|---|
| SMILES | CCN(CC)C(=C(C(=O)N(CC)CC)Cl)C |
Product Overview
2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide (CAS 84912-05-0), with molecular formula C12H23ClN2O and molecular weight 246.15 g/mol. IUPAC: 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide.
Chemical Property Profile of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide
Property Insights of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide
The XLogP value of 2.6669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide. With a topological polar surface area (TPSA) of 23.55 Ų, 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide has 0 hydrogen bond donor(s) and 2 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 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide?
The CAS number of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide is 84912-05-0.
What is the molecular formula of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide?
The molecular formula of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide is C12H23ClN2O.
What is the molecular weight of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide?
The molecular weight of 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide is 246.15 g/mol.
Where can I buy 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide?
You can request a quote for 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-3-(diethylamino)-N,N-diethylbut-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.