BAS 01257329
TL;DR: BAS 01257329 (CAS 525581-47-9) is a chemical compound with molecular formula C21H23N5O5S and molecular weight 457.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[[2-(4-nitrophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]methylideneamino]ethyl]benzenesulfonamide
Also Known As: BAS 01257329, 4-[2-[[(E)-[1-(4-nitrophenyl)-5-oxo-3-propylpyrazol-4-ylidene]methyl]amino]ethyl]benzenesulfonamide, 4-[2-({(E)-[5-hydroxy-1-(4-nitrophenyl)-3-propyl-1H-pyrazol-4-yl]methylidene}amino)ethyl]benzenesulfonamide, 4-[2-[[2-(4-Nitrophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]methylideneamino]ethyl]benzenesulfonamide, (E)-4-(2-(((1-(4-nitrophenyl)-5-oxo-3-propyl-1H-pyrazol-4(5H)-ylidene)methyl)amino)ethyl)benzenesulfonamide
| Molecular Formula | C21H23N5O5S |
|---|---|
| Molecular Weight | 457.14 g/mol |
| LogP | 2.3353 |
| Topological Polar Surface Area | 153.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 457.142 |
| Heavy Atoms | 32 |
| Complexity | 1289.8435 |
Chemical Identifiers
| CAS Number | 525581-47-9 |
|---|---|
| SMILES | CCCC1=C(C(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-])C=NCCC3=CC=C(C=C3)S(=O)(=O)N |
Product Overview
BAS 01257329 (CAS 525581-47-9), with molecular formula C21H23N5O5S and molecular weight 457.14 g/mol. IUPAC: 4-[2-[[2-(4-nitrophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]methylideneamino]ethyl]benzenesulfonamide.
Chemical Property Profile of BAS 01257329
Property Insights of BAS 01257329
The XLogP value of 2.3353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01257329. The TPSA of 153.45 Ų indicates high polarity, suggesting BAS 01257329 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01257329 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 01257329?
The CAS number of BAS 01257329 is 525581-47-9.
What is the molecular formula of BAS 01257329?
The molecular formula of BAS 01257329 is C21H23N5O5S.
What is the molecular weight of BAS 01257329?
The molecular weight of BAS 01257329 is 457.14 g/mol.
Where can I buy BAS 01257329?
You can request a quote for BAS 01257329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01257329?
Yes, KEHONG BIO provides custom synthesis services for BAS 01257329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.