AJ-292/40706671
TL;DR: AJ-292/40706671 (CAS 374910-98-2) is a chemical compound with molecular formula C22H24N2O2S2 and molecular weight 412.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxyphenyl)methylsulfanyl]-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AJ-292/40706671, 2-[(4-methoxyphenyl)methylsulfanyl]-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-allyl-2-[(4-methoxybenzyl)sulfanyl]-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-[(4-methoxybenzyl)sulfanyl]-7-methyl-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 3-allyl-2-((4-methoxybenzyl)thio)-7-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C22H24N2O2S2 |
|---|---|
| Molecular Weight | 412.13 g/mol |
| LogP | 5.0697 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.12793 |
| Heavy Atoms | 28 |
| Complexity | 1066.8157 |
Chemical Identifiers
| CAS Number | 374910-98-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)OC)CC=C |
Product Overview
AJ-292/40706671 (CAS 374910-98-2), with molecular formula C22H24N2O2S2 and molecular weight 412.13 g/mol. IUPAC: 2-[(4-methoxyphenyl)methylsulfanyl]-7-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AJ-292/40706671
Property Insights of AJ-292/40706671
The XLogP value of 5.0697 indicates that AJ-292/40706671 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, AJ-292/40706671 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/40706671 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AJ-292/40706671?
The CAS number of AJ-292/40706671 is 374910-98-2.
What is the molecular formula of AJ-292/40706671?
The molecular formula of AJ-292/40706671 is C22H24N2O2S2.
What is the molecular weight of AJ-292/40706671?
The molecular weight of AJ-292/40706671 is 412.13 g/mol.
Where can I buy AJ-292/40706671?
You can request a quote for AJ-292/40706671 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40706671?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40706671 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.