6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one
TL;DR: 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one (CAS 846590-22-5) is a chemical compound with molecular formula C18H20IN3O4S and molecular weight 501.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)sulfanyl-3-(2-oxopropyl)quinazolin-4-one
Also Known As: 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one, 6-iodo-2-(1-morpholin-4-yl-1-oxo-propan-2-yl)sulfanyl-3-(2-oxopropyl)quinazolin-4-one, 6-iodo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)sulfanyl-3-(2-oxopropyl)quinazolin-4-one, 6-iodo-2-{[1-(morpholin-4-yl)-1-oxopropan-2-yl]sulfanyl}-3-(2-oxopropyl)quinazolin-4(3H)-one
| Molecular Formula | C18H20IN3O4S |
|---|---|
| Molecular Weight | 501.02 g/mol |
| LogP | 1.9295 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.0219 |
| Heavy Atoms | 27 |
| Complexity | 940.08405 |
Chemical Identifiers
| CAS Number | 846590-22-5 |
|---|---|
| SMILES | CC(C(=O)N1CCOCC1)SC2=NC3=C(C=C(C=C3)I)C(=O)N2CC(=O)C |
Product Overview
6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one (CAS 846590-22-5), with molecular formula C18H20IN3O4S and molecular weight 501.02 g/mol. IUPAC: 6-iodo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)sulfanyl-3-(2-oxopropyl)quinazolin-4-one.
Chemical Property Profile of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one
Property Insights of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one
The XLogP value of 1.9295 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one?
The CAS number of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one is 846590-22-5.
What is the molecular formula of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one?
The molecular formula of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one is C18H20IN3O4S.
What is the molecular weight of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one?
The molecular weight of 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one is 501.02 g/mol.
Where can I buy 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one?
You can request a quote for 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-iodo-2-((1-morpholino-1-oxopropan-2-yl)thio)-3-(2-oxopropyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.