BAS 00759778
TL;DR: BAS 00759778 (CAS 328076-05-7) is a chemical compound with molecular formula C24H16ClF3N2O4 and molecular weight 488.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-5-[5-[(Z)-[3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrazol-4-ylidene]methyl]furan-2-yl]benzoate
Also Known As: BAS 00759778, methyl 2-chloro-5-[5-[(Z)-[3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrazol-4-ylidene]methyl]furan-2-yl]benzoate, F0901-2947, (Z)-methyl 2-chloro-5-(5-((3-methyl-5-oxo-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-4(5H)-ylidene)methyl)furan-2-yl)benzoate, METHYL 2-CHLORO-5-(5-{[(4Z)-3-METHYL-5-OXO-1-[3-(TRIFLUOROMETHYL)PHENYL]-4,5-DIHYDRO-1H-PYRAZOL-4-YLIDENE]METHYL}FURAN-2-YL)BENZOATE
| Molecular Formula | C24H16ClF3N2O4 |
|---|---|
| Molecular Weight | 488.08 g/mol |
| LogP | 6.2115 |
| Topological Polar Surface Area | 72.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.07507 |
| Heavy Atoms | 34 |
| Complexity | 1358.243 |
Chemical Identifiers
| CAS Number | 328076-05-7 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)OC)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
BAS 00759778 (CAS 328076-05-7), with molecular formula C24H16ClF3N2O4 and molecular weight 488.08 g/mol. IUPAC: methyl 2-chloro-5-[5-[(Z)-[3-methyl-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrazol-4-ylidene]methyl]furan-2-yl]benzoate.
Chemical Property Profile of BAS 00759778
Property Insights of BAS 00759778
The XLogP value of 6.2115 indicates that BAS 00759778 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00759778. Following Lipinski's Rule of Five, BAS 00759778 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00759778?
The CAS number of BAS 00759778 is 328076-05-7.
What is the molecular formula of BAS 00759778?
The molecular formula of BAS 00759778 is C24H16ClF3N2O4.
What is the molecular weight of BAS 00759778?
The molecular weight of BAS 00759778 is 488.08 g/mol.
Where can I buy BAS 00759778?
You can request a quote for BAS 00759778 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00759778?
Yes, KEHONG BIO provides custom synthesis services for BAS 00759778 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.