Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-
TL;DR: Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- (CAS 59288-17-4) is a chemical compound with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-(4-methylpiperazin-1-yl)chromen-2-one
Also Known As: 3-Amino-4-(4-methyl-1-piperazinyl)coumarin, COUMARIN, 3-AMINO-4-(4-METHYL-1-PIPERAZINYL)-, 3-amino-4-(4-methylpiperazin-1-yl)chromen-2-one, 5-23-02-00494 (Beilstein Handbook Reference), BAS 01052333
| Molecular Formula | C14H17N3O2 |
|---|---|
| Molecular Weight | 259.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.13208 |
| Heavy Atoms | 19 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 59288-17-4 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C(=O)OC3=CC=CC=C32)N |
| InChIKey | OZISUROFJWDSRG-UHFFFAOYSA-N |
Product Overview
Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- (CAS 59288-17-4), with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol. IUPAC: 3-amino-4-(4-methylpiperazin-1-yl)chromen-2-one.
Chemical Property Profile of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-
Property Insights of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-. With a topological polar surface area (TPSA) of 58.8 Ų, Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- has 1 hydrogen bond donor(s) and 5 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 Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-?
The CAS number of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- is 59288-17-4.
What is the molecular formula of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-?
The molecular formula of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- is C14H17N3O2.
What is the molecular weight of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-?
The molecular weight of Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- is 259.13 g/mol.
Where can I buy Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-?
You can request a quote for Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Coumarin, 3-amino-4-(4-methyl-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.