AJ-292/12515070
TL;DR: AJ-292/12515070 (CAS 351441-29-7) is a chemical compound with molecular formula C25H30N2O4S2 and molecular weight 486.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-[(12-ethyl-12-methyl-3-oxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
Also Known As: AJ-292/12515070, pentyl [(6-ethyl-6-methyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate, Pentyl 2-[(12-ethyl-12-methyl-3-oxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate, pentyl 2-[(6-ethyl-6-methyl-4-oxo-3-phenyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-2-yl)sulfanyl]acetate, pentyl 2-((6-ethyl-6-methyl-4-oxo-3-phenyl-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
| Molecular Formula | C25H30N2O4S2 |
|---|---|
| Molecular Weight | 486.16 g/mol |
| LogP | 5.5141 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 486.1647 |
| Heavy Atoms | 33 |
| Complexity | 1188.5753 |
Chemical Identifiers
| CAS Number | 351441-29-7 |
|---|---|
| SMILES | CCCCCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)(C)CC)C(=O)N1C4=CC=CC=C4 |
Product Overview
AJ-292/12515070 (CAS 351441-29-7), with molecular formula C25H30N2O4S2 and molecular weight 486.16 g/mol. IUPAC: pentyl 2-[(12-ethyl-12-methyl-3-oxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate.
Chemical Property Profile of AJ-292/12515070
Property Insights of AJ-292/12515070
The XLogP value of 5.5141 indicates that AJ-292/12515070 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/12515070. Following Lipinski's Rule of Five, AJ-292/12515070 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AJ-292/12515070?
The CAS number of AJ-292/12515070 is 351441-29-7.
What is the molecular formula of AJ-292/12515070?
The molecular formula of AJ-292/12515070 is C25H30N2O4S2.
What is the molecular weight of AJ-292/12515070?
The molecular weight of AJ-292/12515070 is 486.16 g/mol.
Where can I buy AJ-292/12515070?
You can request a quote for AJ-292/12515070 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/12515070?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/12515070 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.