BAS 01257434
TL;DR: BAS 01257434 (CAS 337341-94-3) is a chemical compound with molecular formula C27H23N3O3S2 and molecular weight 501.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-(1,3-benzothiazol-2-yl)-4-[(2,4-dimethoxyphenyl)methylidene]-5-[(4-methylphenyl)sulfanylmethyl]pyrazol-3-one
Also Known As: BAS 01257434, (4E)-2-(1,3-benzothiazol-2-yl)-4-(2,4-dimethoxybenzylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one, (4E)-1-(1,3-BENZOTHIAZOL-2-YL)-4-[(2,4-DIMETHOXYPHENYL)METHYLIDENE]-3-{[(4-METHYLPHENYL)SULFANYL]METHYL}-4,5-DIHYDRO-1H-PYRAZOL-5-ONE, (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2,4-dimethoxyphenyl)methylidene]-5-[(4-methylphenyl)sulfanylmethyl]pyrazol-3-one, (E)-1-(benzo[d]thiazol-2-yl)-4-(2,4-dimethoxybenzylidene)-3-((p-tolylthio)methyl)-1H-pyrazol-5(4H)-one
| Molecular Formula | C27H23N3O3S2 |
|---|---|
| Molecular Weight | 501.12 g/mol |
| LogP | 6.20042 |
| Topological Polar Surface Area | 64.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.11807 |
| Heavy Atoms | 35 |
| Complexity | 1425.3203 |
Chemical Identifiers
| CAS Number | 337341-94-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCC\2=NN(C(=O)/C2=C/C3=C(C=C(C=C3)OC)OC)C4=NC5=CC=CC=C5S4 |
Product Overview
BAS 01257434 (CAS 337341-94-3), with molecular formula C27H23N3O3S2 and molecular weight 501.12 g/mol. IUPAC: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2,4-dimethoxyphenyl)methylidene]-5-[(4-methylphenyl)sulfanylmethyl]pyrazol-3-one.
Chemical Property Profile of BAS 01257434
Property Insights of BAS 01257434
The XLogP value of 6.20042 indicates that BAS 01257434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01257434. Following Lipinski's Rule of Five, BAS 01257434 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01257434?
The CAS number of BAS 01257434 is 337341-94-3.
What is the molecular formula of BAS 01257434?
The molecular formula of BAS 01257434 is C27H23N3O3S2.
What is the molecular weight of BAS 01257434?
The molecular weight of BAS 01257434 is 501.12 g/mol.
Where can I buy BAS 01257434?
You can request a quote for BAS 01257434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01257434?
Yes, KEHONG BIO provides custom synthesis services for BAS 01257434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.