6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one
TL;DR: 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one (CAS 664993-05-9) is a chemical compound with molecular formula C17H18IN3O3S and molecular weight 471.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one
Also Known As: 6-iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one, AL-281/41935164, 3-allyl-6-iodo-2-{[2-(4-morpholinyl)-2-oxoethyl]sulfanyl}-4(3H)-quinazolinone, 3-allyl-6-iodo-2-((2-morpholino-2-oxoethyl)thio)quinazolin-4(3H)-one, 6-iodo-2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
| Molecular Formula | C17H18IN3O3S |
|---|---|
| Molecular Weight | 471.01 g/mol |
| LogP | 2.138 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.01135 |
| Heavy Atoms | 25 |
| Complexity | 862.07227 |
Chemical Identifiers
| CAS Number | 664993-05-9 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(C=CC(=C2)I)N=C1SCC(=O)N3CCOCC3 |
Product Overview
6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one (CAS 664993-05-9), with molecular formula C17H18IN3O3S and molecular weight 471.01 g/mol. IUPAC: 6-iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one.
Chemical Property Profile of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one
Property Insights of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one
The XLogP value of 2.138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one. Following Lipinski's Rule of Five, 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one has 0 hydrogen bond donor(s) and 5 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 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one?
The CAS number of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one is 664993-05-9.
What is the molecular formula of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one?
The molecular formula of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one is C17H18IN3O3S.
What is the molecular weight of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one?
The molecular weight of 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one is 471.01 g/mol.
Where can I buy 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one?
You can request a quote for 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-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-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Iodo-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.