![4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile structure](/static/products/126/126308-56-3.png)
4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile
TL;DR: 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile (CAS 126308-56-3) is a chemical compound with molecular formula C15H18N6 and molecular weight 282.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylpiperazin-1-yl)-8,9-dihydro-7H-pyrimido[5,4-a]pyrrolizine-5-carbonitrile
Also Known As: 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile, 1-(4-methylpiperazin-1-yl)-8,9-dihydro-7H-pyrimido[5,4-a]pyrrolizine-5-carbonitrile
| Molecular Formula | C15H18N6 |
|---|---|
| Molecular Weight | 282.16 g/mol |
| LogP | 1.00098 |
| Topological Polar Surface Area | 60.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.1593 |
| Heavy Atoms | 21 |
| Complexity | 732.6823 |
Chemical Identifiers
| CAS Number | 126308-56-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC=NC3=C(N4CCCC4=C32)C#N |
Product Overview
4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile (CAS 126308-56-3), with molecular formula C15H18N6 and molecular weight 282.16 g/mol. IUPAC: 1-(4-methylpiperazin-1-yl)-8,9-dihydro-7H-pyrimido[5,4-a]pyrrolizine-5-carbonitrile.
Chemical Property Profile of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile
Property Insights of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile
The XLogP value of 1.00098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile. The TPSA of 60.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile. Following Lipinski's Rule of Five, 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile has 0 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 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile?
The CAS number of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile is 126308-56-3.
What is the molecular formula of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile?
The molecular formula of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile is C15H18N6.
What is the molecular weight of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile?
The molecular weight of 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile is 282.16 g/mol.
Where can I buy 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile?
You can request a quote for 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-pyrimido[5,4-a]pyrrolizine-9-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.