1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione structure

1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione

TL;DR: 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione (CAS 899412-25-0) is a chemical compound with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

4,7-dimethyl-2-(3-methylbutyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione

Also Known As: 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione, 4,7-dimethyl-2-(3-methylbutyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione, 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 3-isopentyl-1,7-dimethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

CAS: 899412-25-0
Molecular Formula C20H23N5O2
Molecular Weight 365.19 g/mol
LogP 2.49312
Topological Polar Surface Area 66.23 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 365.18518
Heavy Atoms 27
Complexity 1255.2332

Chemical Identifiers

CAS Number 899412-25-0
SMILES CC1=CN2C3=C(N=C2N1C4=CC=CC=C4)N(C(=O)N(C3=O)CCC(C)C)C

Product Overview

1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione (CAS 899412-25-0), with molecular formula C20H23N5O2 and molecular weight 365.19 g/mol. IUPAC: 4,7-dimethyl-2-(3-methylbutyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione

XLogP
2.49312
TPSA (Topological Polar Surface Area)
66.23
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
27
Complexity
1255.2332
Exact Mass
365.18518
Monoisotopic Mass
365.18518
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione

The XLogP value of 2.49312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione. Following Lipinski's Rule of Five, 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione 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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?

The CAS number of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is 899412-25-0.

What is the molecular formula of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?

The molecular formula of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is C20H23N5O2.

What is the molecular weight of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?

The molecular weight of 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione is 365.19 g/mol.

Where can I buy 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?

You can request a quote for 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione?

Yes, KEHONG BIO provides custom synthesis services for 1,7-dimethyl-3-(3-methylbutyl)-8-phenyl-1,3,5-trihydro-4-imidazolino[1,2-h]pur ine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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