BAS 01174206
TL;DR: BAS 01174206 (CAS 332144-79-3) is a chemical compound with molecular formula C19H16N4O3 and molecular weight 348.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(cyclopropyliminomethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one
Also Known As: BAS 01174206, BIM-0035492.P001, 4-[(cyclopropylimino)methyl]-2-{4-nitrophenyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one, 4-(cyclopropyliminomethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one, 4-[(cyclopropylamino)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one
| Molecular Formula | C19H16N4O3 |
|---|---|
| Molecular Weight | 348.12 g/mol |
| LogP | 3.3221 |
| Topological Polar Surface Area | 93.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.12225 |
| Heavy Atoms | 26 |
| Complexity | 1028.8962 |
Chemical Identifiers
| CAS Number | 332144-79-3 |
|---|---|
| SMILES | C1CC1N=CC2=C(NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
BAS 01174206 (CAS 332144-79-3), with molecular formula C19H16N4O3 and molecular weight 348.12 g/mol. IUPAC: 4-(cyclopropyliminomethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of BAS 01174206
Property Insights of BAS 01174206
The XLogP value of 3.3221 indicates that BAS 01174206 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01174206. Following Lipinski's Rule of Five, BAS 01174206 has 1 hydrogen bond donor(s) and 4 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 01174206?
The CAS number of BAS 01174206 is 332144-79-3.
What is the molecular formula of BAS 01174206?
The molecular formula of BAS 01174206 is C19H16N4O3.
What is the molecular weight of BAS 01174206?
The molecular weight of BAS 01174206 is 348.12 g/mol.
Where can I buy BAS 01174206?
You can request a quote for BAS 01174206 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01174206?
Yes, KEHONG BIO provides custom synthesis services for BAS 01174206 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.