BAS 02234638
TL;DR: BAS 02234638 (CAS 141736-08-5) is a chemical compound with molecular formula C22H18N4O4 and molecular weight 402.1328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)prop-2-enamide
Also Known As: BAS 02234638, (2E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide, (2E)-3-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-N-(2,3-dimethyl-5-oxo-1-phenyl(3-pyr azolin-4-yl))-2-cyanoprop-2-enamide, (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)prop-2-enamide, (E)-3-(benzo[d][1,3]dioxol-5-yl)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acrylamide
Technical Specifications
| Molecular Formula | C22H18N4O4 |
| Molecular Weight | 402.1328 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 94.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.1328 Da |
| Heavy Atoms | 30 |
| Complexity | 820.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/C#N |
| InChIKey | BXQQCSMELJZPNH-MHWRWJLKSA-N |
Chemical Property Profile of BAS 02234638
Property Insights of BAS 02234638
The XLogP value of 3.8 indicates that BAS 02234638 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02234638. Following Lipinski's Rule of Five, BAS 02234638 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 02234638?
The CAS number of BAS 02234638 is 141736-08-5.
What is the molecular formula of BAS 02234638?
The molecular formula of BAS 02234638 is C22H18N4O4.
What is the molecular weight of BAS 02234638?
The molecular weight of BAS 02234638 is 402.1328 g/mol.
Where can I buy BAS 02234638?
You can request a quote for BAS 02234638 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 02234638?
Yes, CoreyChem provides custom synthesis services for BAS 02234638 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.