3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-
TL;DR: 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- (CAS 49582-63-0) is a chemical compound with molecular formula C7H14N2O and molecular weight 142.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(dimethylamino)-3-(methylamino)but-3-en-2-one
Also Known As: 4- -3- -3-buten-2-one, 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-, (Z)-4-(dimethylamino)-3-(methylamino)but-3-en-2-one, (3Z)-4-(Dimethylamino)-3-(methylamino)-3-buten-2-one #
| Molecular Formula | C7H14N2O |
|---|---|
| Molecular Weight | 142.11 g/mol |
| LogP | 0.1978 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 142.11061 |
| Heavy Atoms | 10 |
| Complexity | 149.68509 |
Chemical Identifiers
| CAS Number | 49582-63-0 |
|---|---|
| SMILES | CC(=O)/C(=C/N(C)C)/NC |
Product Overview
3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- (CAS 49582-63-0), with molecular formula C7H14N2O and molecular weight 142.11 g/mol. IUPAC: (Z)-4-(dimethylamino)-3-(methylamino)but-3-en-2-one.
Chemical Property Profile of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-
Property Insights of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-
The XLogP value of 0.1978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-. With a topological polar surface area (TPSA) of 32.34 Ų, 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- 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 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-?
The CAS number of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- is 49582-63-0.
What is the molecular formula of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-?
The molecular formula of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- is C7H14N2O.
What is the molecular weight of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-?
The molecular weight of 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- is 142.11 g/mol.
Where can I buy 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-?
You can request a quote for 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Buten-2-one, 4-(dimethylamino)-3-(methylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.