AJ-292/12676483
TL;DR: AJ-292/12676483 (CAS 346727-45-5) is a chemical compound with molecular formula C19H16Cl2N2OS2 and molecular weight 422.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[(3,4-dichlorophenyl)methylsulfanyl]-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: AJ-292/12676483, 3-allyl-2-[(3,4-dichlorobenzyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 10-[(3,4-Dichlorophenyl)methylsulfanyl]-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one, 10-{[(3,4-dichlorophenyl)methyl]sulfanyl}-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-12-one, 2-[(3,4-dichlorobenzyl)sulfanyl]-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C19H16Cl2N2OS2 |
|---|---|
| Molecular Weight | 422.01 g/mol |
| LogP | 5.7318 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.00812 |
| Heavy Atoms | 26 |
| Complexity | 1071.5669 |
Chemical Identifiers
| CAS Number | 346727-45-5 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC3=CC(=C(C=C3)Cl)Cl)SC4=C2CCC4 |
Product Overview
AJ-292/12676483 (CAS 346727-45-5), with molecular formula C19H16Cl2N2OS2 and molecular weight 422.01 g/mol. IUPAC: 10-[(3,4-dichlorophenyl)methylsulfanyl]-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of AJ-292/12676483
Property Insights of AJ-292/12676483
The XLogP value of 5.7318 indicates that AJ-292/12676483 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, AJ-292/12676483 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-292/12676483 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AJ-292/12676483?
The CAS number of AJ-292/12676483 is 346727-45-5.
What is the molecular formula of AJ-292/12676483?
The molecular formula of AJ-292/12676483 is C19H16Cl2N2OS2.
What is the molecular weight of AJ-292/12676483?
The molecular weight of AJ-292/12676483 is 422.01 g/mol.
Where can I buy AJ-292/12676483?
You can request a quote for AJ-292/12676483 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/12676483?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/12676483 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.