ChemDiv1_009960
TL;DR: ChemDiv1_009960 (CAS 438459-83-7) is a chemical compound with molecular formula C25H26N4O2S2 and molecular weight 478.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[4-(diethylamino)phenyl]methylidene]-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: ChemDiv1_009960, (5Z)-5-[4-(diethylamino)benzylidene]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[[4-(diethylamino)phenyl]methylidene]-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-{[4-(DIETHYLAMINO)PHENYL]METHYLIDENE}-3-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (Z)-5-(4-(diethylamino)benzylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxothiazolidin-4-one
| Molecular Formula | C25H26N4O2S2 |
|---|---|
| Molecular Weight | 478.15 g/mol |
| LogP | 4.73642 |
| Topological Polar Surface Area | 50.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.14972 |
| Heavy Atoms | 33 |
| Complexity | 1286.4363 |
Chemical Identifiers
| CAS Number | 438459-83-7 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C |
Product Overview
ChemDiv1_009960 (CAS 438459-83-7), with molecular formula C25H26N4O2S2 and molecular weight 478.15 g/mol. IUPAC: (5Z)-5-[[4-(diethylamino)phenyl]methylidene]-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of ChemDiv1_009960
Property Insights of ChemDiv1_009960
The XLogP value of 4.73642 indicates that ChemDiv1_009960 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.48 Ų, ChemDiv1_009960 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_009960 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 ChemDiv1_009960?
The CAS number of ChemDiv1_009960 is 438459-83-7.
What is the molecular formula of ChemDiv1_009960?
The molecular formula of ChemDiv1_009960 is C25H26N4O2S2.
What is the molecular weight of ChemDiv1_009960?
The molecular weight of ChemDiv1_009960 is 478.15 g/mol.
Where can I buy ChemDiv1_009960?
You can request a quote for ChemDiv1_009960 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009960?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009960 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.