BAS 01369198
TL;DR: BAS 01369198 (CAS 330202-25-0) is a chemical compound with molecular formula C23H21N3O5S and molecular weight 451.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(3-nitrophenyl)-3,4-dihydropyrazole
Also Known As: BAS 01369198, 3-(4-methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazole, 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(3-nitrophenyl)-3,4-dihydropyrazole, 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-1-tosyl-4,5-dihydro-1H-pyrazole, 3-(4-methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-5-(3-nitrophenyl)-2-pyrazolin e
| Molecular Formula | C23H21N3O5S |
|---|---|
| Molecular Weight | 451.12 g/mol |
| LogP | 4.45182 |
| Topological Polar Surface Area | 102.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.12018 |
| Heavy Atoms | 32 |
| Complexity | 1285.9669 |
Chemical Identifiers
| CAS Number | 330202-25-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)OC)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
BAS 01369198 (CAS 330202-25-0), with molecular formula C23H21N3O5S and molecular weight 451.12 g/mol. IUPAC: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3-(3-nitrophenyl)-3,4-dihydropyrazole.
Chemical Property Profile of BAS 01369198
Property Insights of BAS 01369198
The XLogP value of 4.45182 indicates that BAS 01369198 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01369198. Following Lipinski's Rule of Five, BAS 01369198 has 0 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 01369198?
The CAS number of BAS 01369198 is 330202-25-0.
What is the molecular formula of BAS 01369198?
The molecular formula of BAS 01369198 is C23H21N3O5S.
What is the molecular weight of BAS 01369198?
The molecular weight of BAS 01369198 is 451.12 g/mol.
Where can I buy BAS 01369198?
You can request a quote for BAS 01369198 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01369198?
Yes, KEHONG BIO provides custom synthesis services for BAS 01369198 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.