AJ-292/13489083
TL;DR: AJ-292/13489083 (CAS 374095-99-5) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3-benzyl-7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)benzohydrazide
Also Known As: AJ-292/13489083, N'-(3-benzyl-7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)benzohydrazide, N'-(3-benzyl-7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)benzohydrazide, N'-(3-benzyl-7-(tert-butyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)benzohydrazide
| Molecular Formula | C28H30N4O2S |
|---|---|
| Molecular Weight | 486.21 g/mol |
| LogP | 5.4142 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.20895 |
| Heavy Atoms | 35 |
| Complexity | 1418.8623 |
Chemical Identifiers
| CAS Number | 374095-99-5 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)NNC(=O)C4=CC=CC=C4)CC5=CC=CC=C5 |
Product Overview
AJ-292/13489083 (CAS 374095-99-5), with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol. IUPAC: N'-(3-benzyl-7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)benzohydrazide.
Chemical Property Profile of AJ-292/13489083
Property Insights of AJ-292/13489083
The XLogP value of 5.4142 indicates that AJ-292/13489083 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/13489083. Following Lipinski's Rule of Five, AJ-292/13489083 has 2 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-292/13489083?
The CAS number of AJ-292/13489083 is 374095-99-5.
What is the molecular formula of AJ-292/13489083?
The molecular formula of AJ-292/13489083 is C28H30N4O2S.
What is the molecular weight of AJ-292/13489083?
The molecular weight of AJ-292/13489083 is 486.21 g/mol.
Where can I buy AJ-292/13489083?
You can request a quote for AJ-292/13489083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/13489083?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/13489083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.