AB01280792-01
TL;DR: AB01280792-01 (CAS 444800-56-0) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-[(E)-(2,4-dioxo-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetate
Also Known As: AB01280792-01, AP-828/41099194, methyl (3-{(E)-[2,4-dioxo-3-(propan-2-yl)-1,3-thiazolidin-5-ylidene]methyl}-1H-indol-1-yl)acetate, methyl {3-[(3-isopropyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-1H-indol-1-yl}acetate, (E)-methyl 2-(3-((3-isopropyl-2,4-dioxothiazolidin-5-ylidene)methyl)-1H-indol-1-yl)acetate
| Molecular Formula | C18H18N2O4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 3.259 |
| Topological Polar Surface Area | 68.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.09872 |
| Heavy Atoms | 25 |
| Complexity | 897.61316 |
Chemical Identifiers
| CAS Number | 444800-56-0 |
|---|---|
| SMILES | CC(C)N1C(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC(=O)OC)/SC1=O |
Product Overview
AB01280792-01 (CAS 444800-56-0), with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol. IUPAC: methyl 2-[3-[(E)-(2,4-dioxo-3-propan-2-yl-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetate.
Chemical Property Profile of AB01280792-01
Property Insights of AB01280792-01
The XLogP value of 3.259 indicates that AB01280792-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01280792-01. Following Lipinski's Rule of Five, AB01280792-01 has 0 hydrogen bond donor(s) and 5 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 AB01280792-01?
The CAS number of AB01280792-01 is 444800-56-0.
What is the molecular formula of AB01280792-01?
The molecular formula of AB01280792-01 is C18H18N2O4S.
What is the molecular weight of AB01280792-01?
The molecular weight of AB01280792-01 is 358.10 g/mol.
Where can I buy AB01280792-01?
You can request a quote for AB01280792-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01280792-01?
Yes, KEHONG BIO provides custom synthesis services for AB01280792-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.