BAS 00417284
TL;DR: BAS 00417284 (CAS 481702-10-7) is a chemical compound with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-oxo-4-[(4-phenoxyphenyl)diazenyl]-4H-pyrazole-1-carbothioamide
Also Known As: BAS 00417284, 3-methyl-5-oxo-4-[(4-phenoxyphenyl)diazenyl]-4,5-dihydro-1H-pyrazole-1-carbothioamide, AN-329/40196021, 3-methyl-5-oxo-4-[(4-phenoxyphenyl)diazenyl]-4H-pyrazole-1-carbothioamide, 3-methyl-5-oxo-4-[(E)-(4-phenoxyphenyl)diazenyl]-4,5-dihydro-1H-pyrazole-1-carbothioamide
| Molecular Formula | C17H15N5O2S |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 3.3929 |
| Topological Polar Surface Area | 92.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.09464 |
| Heavy Atoms | 25 |
| Complexity | 849.10175 |
Chemical Identifiers
| CAS Number | 481702-10-7 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=S)N |
Product Overview
BAS 00417284 (CAS 481702-10-7), with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol. IUPAC: 3-methyl-5-oxo-4-[(4-phenoxyphenyl)diazenyl]-4H-pyrazole-1-carbothioamide.
Chemical Property Profile of BAS 00417284
Property Insights of BAS 00417284
The XLogP value of 3.3929 indicates that BAS 00417284 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00417284. Following Lipinski's Rule of Five, BAS 00417284 has 1 hydrogen bond donor(s) and 6 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 BAS 00417284?
The CAS number of BAS 00417284 is 481702-10-7.
What is the molecular formula of BAS 00417284?
The molecular formula of BAS 00417284 is C17H15N5O2S.
What is the molecular weight of BAS 00417284?
The molecular weight of BAS 00417284 is 353.09 g/mol.
Where can I buy BAS 00417284?
You can request a quote for BAS 00417284 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00417284?
Yes, KEHONG BIO provides custom synthesis services for BAS 00417284 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.