1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea
TL;DR: 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea (CAS 72045-76-2) is a chemical compound with molecular formula C27H26N4O2S and molecular weight 470.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)-N-(phenylcarbamothioyl)pentanamide
Also Known As: 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea, 4-Methyl-2-(4-oxo-2-phenylquinazolin-3(4H)-yl)-N-(phenylcarbamothioyl)pentanamide, Urea, 1-(4-methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thio-, 1-[4-methyl-2-(4-oxo-2-phenyl-3,4-dihydroquinazolin-3-yl)pentanoyl]-3-phenylthiourea, 4-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)-N-(phenylcarbamothioyl)pentanamide
| Molecular Formula | C27H26N4O2S |
|---|---|
| Molecular Weight | 470.18 g/mol |
| LogP | 5.1639 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.17764 |
| Heavy Atoms | 34 |
| Complexity | 1368.0468 |
Chemical Identifiers
| CAS Number | 72045-76-2 |
|---|---|
| SMILES | CC(C)CC(C(=O)NC(=S)NC1=CC=CC=C1)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4 |
Product Overview
1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea (CAS 72045-76-2), with molecular formula C27H26N4O2S and molecular weight 470.18 g/mol. IUPAC: 4-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)-N-(phenylcarbamothioyl)pentanamide.
Chemical Property Profile of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea
Property Insights of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea
The XLogP value of 5.1639 indicates that 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea. Following Lipinski's Rule of Five, 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea?
The CAS number of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea is 72045-76-2.
What is the molecular formula of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea?
The molecular formula of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea is C27H26N4O2S.
What is the molecular weight of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea?
The molecular weight of 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea is 470.18 g/mol.
Where can I buy 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea?
You can request a quote for 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-phenyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.