BAS 00345192
TL;DR: BAS 00345192 (CAS 314292-44-9) is a chemical compound with molecular formula C20H15N5O3S and molecular weight 405.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]benzoic acid
Also Known As: BAS 00345192, 3-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic acid, 3-[[5-Methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]benzoic acid, 3-(2-(3-Methyl-5-oxo-1-(4-phenylthiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl)benzoic acid, 3-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-yliden]hydrazino}benzoic acid
| Molecular Formula | C20H15N5O3S |
|---|---|
| Molecular Weight | 405.09 g/mol |
| LogP | 4.71112 |
| Topological Polar Surface Area | 112.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.08957 |
| Heavy Atoms | 29 |
| Complexity | 1270.7711 |
Chemical Identifiers
| CAS Number | 314292-44-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=CC=C3)N=NC4=CC=CC(=C4)C(=O)O |
Product Overview
BAS 00345192 (CAS 314292-44-9), with molecular formula C20H15N5O3S and molecular weight 405.09 g/mol. IUPAC: 3-[[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]diazenyl]benzoic acid.
Chemical Property Profile of BAS 00345192
Property Insights of BAS 00345192
The XLogP value of 4.71112 indicates that BAS 00345192 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00345192. Following Lipinski's Rule of Five, BAS 00345192 has 2 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 00345192?
The CAS number of BAS 00345192 is 314292-44-9.
What is the molecular formula of BAS 00345192?
The molecular formula of BAS 00345192 is C20H15N5O3S.
What is the molecular weight of BAS 00345192?
The molecular weight of BAS 00345192 is 405.09 g/mol.
Where can I buy BAS 00345192?
You can request a quote for BAS 00345192 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00345192?
Yes, KEHONG BIO provides custom synthesis services for BAS 00345192 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.