C22H24N4O4S
TL;DR: C22H24N4O4S (CAS 329227-49-8) is a chemical compound with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide
Also Known As: AF-399/40713969, N-[(E)-(3,4-Dimethoxyphenyl)methylideneamino]-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide, (E)-N'-(3,4-dimethoxybenzylidene)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide, N'-(3,4-dimethoxybenzylidene)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide, N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide
| Molecular Formula | C22H24N4O4S |
|---|---|
| Molecular Weight | 440.15 g/mol |
| LogP | 2.7503 |
| Topological Polar Surface Area | 94.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.15182 |
| Heavy Atoms | 31 |
| Complexity | 1214.1766 |
Chemical Identifiers
| CAS Number | 329227-49-8 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC(=O)N/N=C/C4=CC(=C(C=C4)OC)OC |
Product Overview
C22H24N4O4S (CAS 329227-49-8), with molecular formula C22H24N4O4S and molecular weight 440.15 g/mol. IUPAC: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide.
Chemical Property Profile of C22H24N4O4S
Property Insights of C22H24N4O4S
The XLogP value of 2.7503 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C22H24N4O4S. The TPSA of 94.81 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H24N4O4S. Following Lipinski's Rule of Five, C22H24N4O4S has 1 hydrogen bond donor(s) and 7 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 C22H24N4O4S?
The CAS number of C22H24N4O4S is 329227-49-8.
What is the molecular formula of C22H24N4O4S?
The molecular formula of C22H24N4O4S is C22H24N4O4S.
What is the molecular weight of C22H24N4O4S?
The molecular weight of C22H24N4O4S is 440.15 g/mol.
Where can I buy C22H24N4O4S?
You can request a quote for C22H24N4O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H24N4O4S?
Yes, KEHONG BIO provides custom synthesis services for C22H24N4O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.