BAS 00572551
TL;DR: BAS 00572551 (CAS 52247-47-9) is a chemical compound with molecular formula C32H26N4O2 and molecular weight 498.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(benzylamino)-1-(1,3-diphenylpyrazol-4-yl)-3-oxoprop-1-en-2-yl]benzamide
Also Known As: BAS 00572551, (E)-N-(3-(benzylamino)-1-(1,3-diphenyl-1H-pyrazol-4-yl)-3-oxoprop-1-en-2-yl)benzamide, N-[(1E)-3-(benzylamino)-1-(1,3-diphenyl-1H-pyrazol-4-yl)-3-oxoprop-1-en-2-yl]benzamide, N-[(E)-3-(benzylamino)-1-(1,3-diphenylpyrazol-4-yl)-3-oxoprop-1-en-2-yl]benzamide
| Molecular Formula | C32H26N4O2 |
|---|---|
| Molecular Weight | 498.21 g/mol |
| LogP | 5.6266 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.20557 |
| Heavy Atoms | 38 |
| Complexity | 1544.9293 |
Chemical Identifiers
| CAS Number | 52247-47-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)/C(=C\C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)/NC(=O)C5=CC=CC=C5 |
Product Overview
BAS 00572551 (CAS 52247-47-9), with molecular formula C32H26N4O2 and molecular weight 498.21 g/mol. IUPAC: N-[(E)-3-(benzylamino)-1-(1,3-diphenylpyrazol-4-yl)-3-oxoprop-1-en-2-yl]benzamide.
Chemical Property Profile of BAS 00572551
Property Insights of BAS 00572551
The XLogP value of 5.6266 indicates that BAS 00572551 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00572551. Following Lipinski's Rule of Five, BAS 00572551 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00572551?
The CAS number of BAS 00572551 is 52247-47-9.
What is the molecular formula of BAS 00572551?
The molecular formula of BAS 00572551 is C32H26N4O2.
What is the molecular weight of BAS 00572551?
The molecular weight of BAS 00572551 is 498.21 g/mol.
Where can I buy BAS 00572551?
You can request a quote for BAS 00572551 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00572551?
Yes, KEHONG BIO provides custom synthesis services for BAS 00572551 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.