ChemDiv1_001574
TL;DR: ChemDiv1_001574 (CAS 190653-67-9) is a chemical compound with molecular formula C24H18N4O5S2 and molecular weight 506.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3Z)-3-[3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetic acid
Also Known As: ChemDiv1_001574, F0207-0616, (Z)-2-(3-(3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-thioxothiazolidin-5-ylidene)-2-oxoindolin-1-yl)acetic acid, 2-[(3Z)-3-[3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetic acid, 2-{3-[(5Z)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid
| Molecular Formula | C24H18N4O5S2 |
|---|---|
| Molecular Weight | 506.07 g/mol |
| LogP | 2.69162 |
| Topological Polar Surface Area | 104.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 506.07187 |
| Heavy Atoms | 35 |
| Complexity | 1536.9313 |
Chemical Identifiers
| CAS Number | 190653-67-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)/C(=C/4\C5=CC=CC=C5N(C4=O)CC(=O)O)/SC3=S |
Product Overview
ChemDiv1_001574 (CAS 190653-67-9), with molecular formula C24H18N4O5S2 and molecular weight 506.07 g/mol. IUPAC: 2-[(3Z)-3-[3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetic acid.
Chemical Property Profile of ChemDiv1_001574
Property Insights of ChemDiv1_001574
The XLogP value of 2.69162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_001574. The TPSA of 104.85 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_001574. Following Lipinski's Rule of Five, ChemDiv1_001574 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_001574?
The CAS number of ChemDiv1_001574 is 190653-67-9.
What is the molecular formula of ChemDiv1_001574?
The molecular formula of ChemDiv1_001574 is C24H18N4O5S2.
What is the molecular weight of ChemDiv1_001574?
The molecular weight of ChemDiv1_001574 is 506.07 g/mol.
Where can I buy ChemDiv1_001574?
You can request a quote for ChemDiv1_001574 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001574?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001574 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.