BAS 00641213
TL;DR: BAS 00641213 (CAS 1164496-26-7) is a chemical compound with molecular formula C27H24N2O2 and molecular weight 408.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4Z)-4-[(E)-3-(2-methoxyphenyl)-1-(4-methylphenyl)prop-2-enylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: BAS 00641213, 4-[3-(2-Methoxy-phenyl)-1-p-tolyl-allylidene]-5-methyl-2-phenyl-2,4-dihydro-pyrazol-3-one, (4Z)-4-[(E)-3-(2-methoxyphenyl)-1-(4-methylphenyl)prop-2-enylidene]-5-methyl-2-phenylpyrazol-3-one, 4-[3-(2-methoxyphenyl)-1-(4-methylphenyl)-2-propenylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Technical Specifications
| Molecular Formula | C27H24N2O2 |
| Molecular Weight | 408.18378 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.18378 Da |
| Heavy Atoms | 31 |
| Complexity | 724.0 |
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)/C=C/C4=CC=CC=C4OC |
| InChIKey | IVZDVNROUSBGJQ-AAVFARQKSA-N |
Chemical Property Profile of BAS 00641213
Property Insights of BAS 00641213
The XLogP value of 6.3 indicates that BAS 00641213 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, BAS 00641213 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00641213 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BAS 00641213?
The CAS number of BAS 00641213 is 1164496-26-7.
What is the molecular formula of BAS 00641213?
The molecular formula of BAS 00641213 is C27H24N2O2.
What is the molecular weight of BAS 00641213?
The molecular weight of BAS 00641213 is 408.18378 g/mol.
Where can I buy BAS 00641213?
You can request a quote for BAS 00641213 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 00641213?
Yes, CoreyChem provides custom synthesis services for BAS 00641213 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.