1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine
TL;DR: 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine (CAS 81816-67-3) is a chemical compound with molecular formula C14H20N2O and molecular weight 232.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydro-2H-chromen-4-yl)-4-methylpiperazine
Also Known As: 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine, Piperazine, 1-(3,4-dihydro-2H-1-benzopyran-4-yl)-4-methyl-, 1-(3,4-dihydro-2H-chromen-4-yl)-4-methylpiperazine, RefChem:1054084, BRN 4460535
| Molecular Formula | C14H20N2O |
|---|---|
| Molecular Weight | 232.16 g/mol |
| LogP | 1.7576 |
| Topological Polar Surface Area | 15.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.15756 |
| Heavy Atoms | 17 |
| Complexity | 385.56354 |
Chemical Identifiers
| CAS Number | 81816-67-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2CCOC3=CC=CC=C23 |
Product Overview
1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine (CAS 81816-67-3), with molecular formula C14H20N2O and molecular weight 232.16 g/mol. IUPAC: 1-(3,4-dihydro-2H-chromen-4-yl)-4-methylpiperazine.
Chemical Property Profile of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine
Property Insights of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine
The XLogP value of 1.7576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine. With a topological polar surface area (TPSA) of 15.71 Ų, 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine has 0 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 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine?
The CAS number of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine is 81816-67-3.
What is the molecular formula of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine?
The molecular formula of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine is C14H20N2O.
What is the molecular weight of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine?
The molecular weight of 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine is 232.16 g/mol.
Where can I buy 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine?
You can request a quote for 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dihydro-2H-1-benzopyran-4-yl)-4-methylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.