BAS 00474082
TL;DR: BAS 00474082 (CAS 5565-08-2) is a chemical compound with molecular formula C25H19N3O2S2 and molecular weight 457.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00474082, 3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(1-naphthylmethylene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C25H19N3O2S2 |
|---|---|
| Molecular Weight | 457.09 g/mol |
| LogP | 5.04342 |
| Topological Polar Surface Area | 47.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.09186 |
| Heavy Atoms | 32 |
| Complexity | 1477.1019 |
Chemical Identifiers
| CAS Number | 5565-08-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)/C(=C/C4=CC=CC5=CC=CC=C54)/SC3=S |
Product Overview
BAS 00474082 (CAS 5565-08-2), with molecular formula C25H19N3O2S2 and molecular weight 457.09 g/mol. IUPAC: (5Z)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00474082
Property Insights of BAS 00474082
The XLogP value of 5.04342 indicates that BAS 00474082 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.24 Ų, BAS 00474082 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00474082 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00474082?
The CAS number of BAS 00474082 is 5565-08-2.
What is the molecular formula of BAS 00474082?
The molecular formula of BAS 00474082 is C25H19N3O2S2.
What is the molecular weight of BAS 00474082?
The molecular weight of BAS 00474082 is 457.09 g/mol.
Where can I buy BAS 00474082?
You can request a quote for BAS 00474082 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00474082?
Yes, KEHONG BIO provides custom synthesis services for BAS 00474082 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.