AB00674368-01
TL;DR: AB00674368-01 (CAS 956987-22-7) is a chemical compound with molecular formula C22H17N3O2S2 and molecular weight 419.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00674368-01, F1423-3965, BRD-A08869158-001-01-5, (5Z)-5-{[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C22H17N3O2S2 |
|---|---|
| Molecular Weight | 419.08 g/mol |
| LogP | 4.3515 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.07623 |
| Heavy Atoms | 29 |
| Complexity | 1168.0554 |
Chemical Identifiers
| CAS Number | 956987-22-7 |
|---|---|
| SMILES | CC1CC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=C\4/C(=O)NC(=S)S4)C5=CC=CC=C5 |
Product Overview
AB00674368-01 (CAS 956987-22-7), with molecular formula C22H17N3O2S2 and molecular weight 419.08 g/mol. IUPAC: (5Z)-5-[[3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of AB00674368-01
Property Insights of AB00674368-01
The XLogP value of 4.3515 indicates that AB00674368-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, AB00674368-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00674368-01 has 1 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 AB00674368-01?
The CAS number of AB00674368-01 is 956987-22-7.
What is the molecular formula of AB00674368-01?
The molecular formula of AB00674368-01 is C22H17N3O2S2.
What is the molecular weight of AB00674368-01?
The molecular weight of AB00674368-01 is 419.08 g/mol.
Where can I buy AB00674368-01?
You can request a quote for AB00674368-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674368-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674368-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.