4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)
TL;DR: 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) (CAS 35739-57-2) is a chemical compound with molecular formula C21H31N3O6 and molecular weight 421.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-butoxy-3-[3-(diethylamino)propyl]quinazolin-4-one;oxalic acid
Also Known As: 7-Butoxy-3-(3-(diethylamino)propyl)-4(3H)-quinazolinone oxalate, 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1), 7-butoxy-3-[3-(diethylamino)propyl]quinazolin-4-one; oxalic acid, Oxalic acid--7-butoxy-3-[3-(diethylamino)propyl]quinazolin-4(3H)-one (1/1), RefChem:284317
| Molecular Formula | C21H31N3O6 |
|---|---|
| Molecular Weight | 421.22 g/mol |
| LogP | 2.46 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 421.22128 |
| Heavy Atoms | 30 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 35739-57-2 |
|---|---|
| SMILES | CCCCOC1=CC2=C(C=C1)C(=O)N(C=N2)CCCN(CC)CC.C(=O)(C(=O)O)O |
| InChIKey | HBUCZTPWYMZDKZ-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) (CAS 35739-57-2), with molecular formula C21H31N3O6 and molecular weight 421.22 g/mol. IUPAC: 7-butoxy-3-[3-(diethylamino)propyl]quinazolin-4-one;oxalic acid.
Chemical Property Profile of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)
Property Insights of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)
The XLogP value of 2.46 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1). The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1). Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) has 2 hydrogen bond donor(s) and 8 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(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)?
The CAS number of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) is 35739-57-2.
What is the molecular formula of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)?
The molecular formula of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) is C21H31N3O6.
What is the molecular weight of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)?
The molecular weight of 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) is 421.22 g/mol.
Where can I buy 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)?
You can request a quote for 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 7-butoxy-3-(3-(diethylamino)propyl)-, oxalate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.