(((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone
TL;DR: (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone (CAS 124674-01-7) is a chemical compound with molecular formula C20H25N5O3 and molecular weight 383.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[1-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-3-methyl-1,3-benzoxazol-2-one
Also Known As: (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone, 6-(1-Hydroxy-4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-3-methyl-2(3H)-benzoxazolone, 2(3H)-Benzoxazolone, 6-(1-hydroxy-4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-3-methyl-, 6-[1-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-3-methyl-1,3-benzoxazol-2-one, 6-{1-Hydroxy-4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}-3-methyl-1,3-benzoxazol-2(3H)-one
| Molecular Formula | C20H25N5O3 |
|---|---|
| Molecular Weight | 383.20 g/mol |
| LogP | 1.5573 |
| Topological Polar Surface Area | 87.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.19574 |
| Heavy Atoms | 28 |
| Complexity | 976.41986 |
Chemical Identifiers
| CAS Number | 124674-01-7 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)C(CCCN3CCN(CC3)C4=NC=CC=N4)O)OC1=O |
Product Overview
(((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone (CAS 124674-01-7), with molecular formula C20H25N5O3 and molecular weight 383.20 g/mol. IUPAC: 6-[1-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-3-methyl-1,3-benzoxazol-2-one.
Chemical Property Profile of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone
Property Insights of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone
The XLogP value of 1.5573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone. The TPSA of 87.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone. Following Lipinski's Rule of Five, (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone has 1 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 (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone?
The CAS number of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone is 124674-01-7.
What is the molecular formula of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone?
The molecular formula of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone is C20H25N5O3.
What is the molecular weight of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone?
The molecular weight of (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone is 383.20 g/mol.
Where can I buy (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone?
You can request a quote for (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone?
Yes, KEHONG BIO provides custom synthesis services for (((Pyrimidino-2)-4 piperazinyl-1)-4 hydroxy-1 butyl)-6 methyl-3 benzoxazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.