AF-399/40713982
TL;DR: AF-399/40713982 (CAS 370844-07-8) is a chemical compound with molecular formula C23H23N5O3S and molecular weight 449.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide
Also Known As: AF-399/40713982, N-(1-Ethyl-2-hydroxyindol-3-yl)imino-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide, (Z)-N'-(1-ethyl-2-oxoindolin-3-ylidene)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide, N'-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide, N'-[(3Z)-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetohydrazide
| Molecular Formula | C23H23N5O3S |
|---|---|
| Molecular Weight | 449.15 g/mol |
| LogP | 4.5735 |
| Topological Polar Surface Area | 101.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.15216 |
| Heavy Atoms | 32 |
| Complexity | 1445.6257 |
Chemical Identifiers
| CAS Number | 370844-07-8 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C(=C1O)N=NC(=O)CN3C=NC4=C(C3=O)C5=C(S4)CC(CC5)C |
Product Overview
AF-399/40713982 (CAS 370844-07-8), with molecular formula C23H23N5O3S and molecular weight 449.15 g/mol. IUPAC: N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide.
Chemical Property Profile of AF-399/40713982
Property Insights of AF-399/40713982
The XLogP value of 4.5735 indicates that AF-399/40713982 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40713982. Following Lipinski's Rule of Five, AF-399/40713982 has 1 hydrogen bond donor(s) and 6 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 AF-399/40713982?
The CAS number of AF-399/40713982 is 370844-07-8.
What is the molecular formula of AF-399/40713982?
The molecular formula of AF-399/40713982 is C23H23N5O3S.
What is the molecular weight of AF-399/40713982?
The molecular weight of AF-399/40713982 is 449.15 g/mol.
Where can I buy AF-399/40713982?
You can request a quote for AF-399/40713982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40713982?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40713982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.