2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-
TL;DR: 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- (CAS 89567-68-0) is a chemical compound with molecular formula C14H17N3O and molecular weight 243.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-N-benzyl-2-cyano-3-(dimethylamino)but-2-enamide
Also Known As: BIM-0033252.P001, N-benzyl-2-cyano-3-(dimethylamino)-2-butenamide, (Z)-N-benzyl-2-cyano-3-(dimethylamino)but-2-enamide, 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-
| Molecular Formula | C14H17N3O |
|---|---|
| Molecular Weight | 243.14 g/mol |
| LogP | 1.66198 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.13716 |
| Heavy Atoms | 18 |
| Complexity | 483.51062 |
Chemical Identifiers
| CAS Number | 89567-68-0 |
|---|---|
| SMILES | C/C(=C(\C#N)/C(=O)NCC1=CC=CC=C1)/N(C)C |
Product Overview
2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- (CAS 89567-68-0), with molecular formula C14H17N3O and molecular weight 243.14 g/mol. IUPAC: (Z)-N-benzyl-2-cyano-3-(dimethylamino)but-2-enamide.
Chemical Property Profile of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-
Property Insights of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-
The XLogP value of 1.66198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-. With a topological polar surface area (TPSA) of 56.13 Ų, 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- 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 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-?
The CAS number of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- is 89567-68-0.
What is the molecular formula of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-?
The molecular formula of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- is C14H17N3O.
What is the molecular weight of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-?
The molecular weight of 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- is 243.14 g/mol.
Where can I buy 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-?
You can request a quote for 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenamide, 2-cyano-3-(dimethylamino)-N-(phenylmethyl)-, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.