![2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one structure](/static/products/488/488121-91-1.png)
2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one
TL;DR: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one (CAS 488121-91-1) is a chemical compound with molecular formula C19H17ClN2OS and molecular weight 356.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-3-chlorobut-2-enyl]sulfanyl-3-(3-methylphenyl)quinazolin-4-one
Also Known As: (Z)-2-((3-chlorobut-2-en-1-yl)thio)-3-(m-tolyl)quinazolin-4(3H)-one, 2-[(Z)-3-chlorobut-2-enyl]sulfanyl-3-(3-methylphenyl)quinazolin-4-one, 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one
| Molecular Formula | C19H17ClN2OS |
|---|---|
| Molecular Weight | 356.07 g/mol |
| LogP | 4.92882 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.075 |
| Heavy Atoms | 24 |
| Complexity | 974.5079 |
Chemical Identifiers
| CAS Number | 488121-91-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC/C=C(/C)\Cl |
Product Overview
2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one (CAS 488121-91-1), with molecular formula C19H17ClN2OS and molecular weight 356.07 g/mol. IUPAC: 2-[(Z)-3-chlorobut-2-enyl]sulfanyl-3-(3-methylphenyl)quinazolin-4-one.
Chemical Property Profile of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one
Property Insights of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one
The XLogP value of 4.92882 indicates that 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 3 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 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one?
The CAS number of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one is 488121-91-1.
What is the molecular formula of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one?
The molecular formula of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one is C19H17ClN2OS.
What is the molecular weight of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one?
The molecular weight of 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one is 356.07 g/mol.
Where can I buy 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one?
You can request a quote for 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)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 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(3-methylphenyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.