AB01300958-01
TL;DR: AB01300958-01 (CAS 677345-81-2) is a chemical compound with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-[(E)-(3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetate
Also Known As: AB01300958-01, methyl {3-[(E)-(3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-1H-indol-1-yl}acetate, (E)-methyl 2-(3-((3-ethyl-2,4-dioxothiazolidin-5-ylidene)methyl)-1H-indol-1-yl)acetate, methyl 2-[3-[(E)-(3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetate
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 2.8705 |
| Topological Polar Surface Area | 68.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 868.5977 |
Chemical Identifiers
| CAS Number | 677345-81-2 |
|---|---|
| SMILES | CCN1C(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC(=O)OC)/SC1=O |
Product Overview
AB01300958-01 (CAS 677345-81-2), with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol. IUPAC: methyl 2-[3-[(E)-(3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]acetate.
Chemical Property Profile of AB01300958-01
Property Insights of AB01300958-01
The XLogP value of 2.8705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01300958-01. The TPSA of 68.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01300958-01. Following Lipinski's Rule of Five, AB01300958-01 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 AB01300958-01?
The CAS number of AB01300958-01 is 677345-81-2.
What is the molecular formula of AB01300958-01?
The molecular formula of AB01300958-01 is C17H16N2O4S.
What is the molecular weight of AB01300958-01?
The molecular weight of AB01300958-01 is 344.08 g/mol.
Where can I buy AB01300958-01?
You can request a quote for AB01300958-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01300958-01?
Yes, KEHONG BIO provides custom synthesis services for AB01300958-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.