but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine
TL;DR: but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine (CAS 7598-05-2) is a chemical compound with molecular formula C14H27N3O4 and molecular weight 301.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine
Also Known As: N,N-DIMETHYL-2-(4-METHYL-1,4-DIAZEPAN-1-YL)ETHANAMINE MALEATE
| Molecular Formula | C14H27N3O4 |
|---|---|
| Molecular Weight | 301.20 g/mol |
| LogP | -0.1027 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.20016 |
| Heavy Atoms | 21 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 7598-05-2 |
|---|---|
| SMILES | CN1CCCN(CC1)CCN(C)C.C(=CC(=O)O)C(=O)O |
| InChIKey | JIFKQTSEEYEDTO-UHFFFAOYSA-N |
Product Overview
but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine (CAS 7598-05-2), with molecular formula C14H27N3O4 and molecular weight 301.20 g/mol. IUPAC: but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine.
Chemical Property Profile of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine
Property Insights of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine
The XLogP value of -0.1027 indicates that but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine. Following Lipinski's Rule of Five, but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine has 2 hydrogen bond donor(s) and 7 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 but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine?
The CAS number of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine is 7598-05-2.
What is the molecular formula of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine?
The molecular formula of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine is C14H27N3O4.
What is the molecular weight of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine?
The molecular weight of but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine is 301.20 g/mol.
Where can I buy but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine?
You can request a quote for but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for but-2-enedioic acid;N,N-dimethyl-2-(4-methyl-1,4-diazepan-1-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.