AO-364/40761369
TL;DR: AO-364/40761369 (CAS 421577-83-5) is a chemical compound with molecular formula C22H22N2O2S2 and molecular weight 410.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AO-364/40761369, 3-allyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 3-allyl-2-((2-oxo-2-(p-tolyl)ethyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C22H22N2O2S2 |
|---|---|
| Molecular Weight | 410.11 g/mol |
| LogP | 4.80622 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.11227 |
| Heavy Atoms | 28 |
| Complexity | 1110.2526 |
Chemical Identifiers
| CAS Number | 421577-83-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C |
Product Overview
AO-364/40761369 (CAS 421577-83-5), with molecular formula C22H22N2O2S2 and molecular weight 410.11 g/mol. IUPAC: 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AO-364/40761369
Property Insights of AO-364/40761369
The XLogP value of 4.80622 indicates that AO-364/40761369 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, AO-364/40761369 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-364/40761369 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 AO-364/40761369?
The CAS number of AO-364/40761369 is 421577-83-5.
What is the molecular formula of AO-364/40761369?
The molecular formula of AO-364/40761369 is C22H22N2O2S2.
What is the molecular weight of AO-364/40761369?
The molecular weight of AO-364/40761369 is 410.11 g/mol.
Where can I buy AO-364/40761369?
You can request a quote for AO-364/40761369 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-364/40761369?
Yes, KEHONG BIO provides custom synthesis services for AO-364/40761369 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.