BAS 00078948
TL;DR: BAS 00078948 (CAS 39143-08-3) is a chemical compound with molecular formula C19H19N3O and molecular weight 305.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[[4-(dimethylamino)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: BAS 00078948, (4Z)-4-[4-(dimethylamino)benzylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (Z)-4-(4-(dimethylamino)benzylidene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one, (4Z)-4-[(4-dimethylaminophenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one, 1-Phenyl-3-methyl-4-[4-(dimethylamino)benzylidene]-1H-pyrazole-5(4H)-one
| Molecular Formula | C19H19N3O |
|---|---|
| Molecular Weight | 305.15 g/mol |
| LogP | 3.5587 |
| Topological Polar Surface Area | 35.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.1528 |
| Heavy Atoms | 23 |
| Complexity | 774.02185 |
Chemical Identifiers
| CAS Number | 39143-08-3 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3 |
Product Overview
BAS 00078948 (CAS 39143-08-3), with molecular formula C19H19N3O and molecular weight 305.15 g/mol. IUPAC: (4Z)-4-[[4-(dimethylamino)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one.
Chemical Property Profile of BAS 00078948
Property Insights of BAS 00078948
The XLogP value of 3.5587 indicates that BAS 00078948 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.91 Ų, BAS 00078948 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00078948 has 0 hydrogen bond donor(s) and 3 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 00078948?
The CAS number of BAS 00078948 is 39143-08-3.
What is the molecular formula of BAS 00078948?
The molecular formula of BAS 00078948 is C19H19N3O.
What is the molecular weight of BAS 00078948?
The molecular weight of BAS 00078948 is 305.15 g/mol.
Where can I buy BAS 00078948?
You can request a quote for BAS 00078948 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00078948?
Yes, KEHONG BIO provides custom synthesis services for BAS 00078948 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.