BAS 00442336
TL;DR: BAS 00442336 (CAS 312947-37-8) is a chemical compound with molecular formula C25H20ClNO3 and molecular weight 417.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-4-(4-methylphenyl)phenyl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
Also Known As: BAS 00442336, [2-methyl-4-(4-methylphenyl)phenyl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate, 3,4'-dimethyl-[1,1'-biphenyl]-4-yl 3-(2-chlorophenyl)-5-methylisoxazole-4-carboxylate, 3,4'-dimethyl[1,1'-biphenyl]-4-yl 3-(2-chlorophenyl)-5-methylisoxazole-4-carboxylate, 3,4'-dimethylbiphenyl-4-yl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
| Molecular Formula | C25H20ClNO3 |
|---|---|
| Molecular Weight | 417.11 g/mol |
| LogP | 6.80646 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.11316 |
| Heavy Atoms | 30 |
| Complexity | 1225.6348 |
Chemical Identifiers
| CAS Number | 312947-37-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C)C |
Product Overview
BAS 00442336 (CAS 312947-37-8), with molecular formula C25H20ClNO3 and molecular weight 417.11 g/mol. IUPAC: [2-methyl-4-(4-methylphenyl)phenyl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate.
Chemical Property Profile of BAS 00442336
Property Insights of BAS 00442336
The XLogP value of 6.80646 indicates that BAS 00442336 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, BAS 00442336 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00442336 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00442336?
The CAS number of BAS 00442336 is 312947-37-8.
What is the molecular formula of BAS 00442336?
The molecular formula of BAS 00442336 is C25H20ClNO3.
What is the molecular weight of BAS 00442336?
The molecular weight of BAS 00442336 is 417.11 g/mol.
Where can I buy BAS 00442336?
You can request a quote for BAS 00442336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00442336?
Yes, KEHONG BIO provides custom synthesis services for BAS 00442336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.