BAS 00448613
TL;DR: BAS 00448613 (CAS 354989-12-1) is a chemical compound with molecular formula C30H24N4O4 and molecular weight 504.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide
Also Known As: BAS 00448613, 5-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide, N-[3-nitro-5-(3-methylphenoxy)phenyl]-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
| Molecular Formula | C30H24N4O4 |
|---|---|
| Molecular Weight | 504.18 g/mol |
| LogP | 7.10894 |
| Topological Polar Surface Area | 99.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.17975 |
| Heavy Atoms | 38 |
| Complexity | 1629.4167 |
Chemical Identifiers
| CAS Number | 354989-12-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C |
Product Overview
BAS 00448613 (CAS 354989-12-1), with molecular formula C30H24N4O4 and molecular weight 504.18 g/mol. IUPAC: 5-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide.
Chemical Property Profile of BAS 00448613
Property Insights of BAS 00448613
The XLogP value of 7.10894 indicates that BAS 00448613 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00448613. Following Lipinski's Rule of Five, BAS 00448613 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00448613?
The CAS number of BAS 00448613 is 354989-12-1.
What is the molecular formula of BAS 00448613?
The molecular formula of BAS 00448613 is C30H24N4O4.
What is the molecular weight of BAS 00448613?
The molecular weight of BAS 00448613 is 504.18 g/mol.
Where can I buy BAS 00448613?
You can request a quote for BAS 00448613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00448613?
Yes, KEHONG BIO provides custom synthesis services for BAS 00448613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.