(3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE
TL;DR: (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE (CAS 617694-95-8) is a chemical compound with molecular formula C23H22N2O2S2 and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[1-[(4-methylphenyl)methyl]-2-oxoindol-3-ylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE, (3Z)-1-(4-methylbenzyl)-3-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one, (5Z)-5-[1-[(4-methylphenyl)methyl]-2-oxoindol-3-ylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 644-247-8, RefChem:401670
| Molecular Formula | C23H22N2O2S2 |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 4.76922 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.11227 |
| Heavy Atoms | 29 |
| Complexity | 1041.0983 |
Chemical Identifiers
| CAS Number | 617694-95-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=CC=CC=C3/C(=C/4\C(=O)N(C(=S)S4)CC(C)C)/C2=O |
Product Overview
(3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE (CAS 617694-95-8), with molecular formula C23H22N2O2S2 and molecular weight 422.11 g/mol. IUPAC: (5Z)-5-[1-[(4-methylphenyl)methyl]-2-oxoindol-3-ylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE
Property Insights of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE
The XLogP value of 4.76922 indicates that (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE has 0 hydrogen bond donor(s) and 4 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 (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE?
The CAS number of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE is 617694-95-8.
What is the molecular formula of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE?
The molecular formula of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE is C23H22N2O2S2.
What is the molecular weight of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE?
The molecular weight of (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE is 422.11 g/mol.
Where can I buy (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE?
You can request a quote for (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-3-(3-ISOBUTYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)-1-(4-METHYLBENZYL)-1,3-DIHYDRO-2H-INDOL-2-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.