Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride
TL;DR: Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride (CAS 75174-37-7) is a chemical compound with molecular formula C16H21Cl2N3O4 and molecular weight 389.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]butanoate;dihydrochloride
Also Known As: Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride, Ethyl 3-oxo-2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]butanoate Dihydrochloride, Ethyl 3-oxo-2-({[(4-oxoquinazolin-3(4H)-yl)methyl]amino}methyl)butanoate--hydrogen chloride (1/2), RefChem:330784
| Molecular Formula | C16H21Cl2N3O4 |
|---|---|
| Molecular Weight | 389.09 g/mol |
| LogP | 1.5555 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.0909 |
| Heavy Atoms | 25 |
| Complexity | 779.309 |
Chemical Identifiers
| CAS Number | 75174-37-7 |
|---|---|
| SMILES | CCOC(=O)C(CNCN1C=NC2=CC=CC=C2C1=O)C(=O)C.Cl.Cl |
Product Overview
Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride (CAS 75174-37-7), with molecular formula C16H21Cl2N3O4 and molecular weight 389.09 g/mol. IUPAC: ethyl 3-oxo-2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]butanoate;dihydrochloride.
Chemical Property Profile of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride
Property Insights of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride
The XLogP value of 1.5555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride. Following Lipinski's Rule of Five, Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride has 1 hydrogen bond donor(s) and 6 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 Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride?
The CAS number of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride is 75174-37-7.
What is the molecular formula of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride?
The molecular formula of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride is C16H21Cl2N3O4.
What is the molecular weight of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride?
The molecular weight of Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride is 389.09 g/mol.
Where can I buy Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride?
You can request a quote for Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 3-oxo-2-((((4-oxo-3(4H)-quinazolinyl)methyl)amino)methyl)-, ethyl ester, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.