BAS 12534651
TL;DR: BAS 12534651 (CAS 876668-30-3) is a chemical compound with molecular formula C21H16FN3O2 and molecular weight 361.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-8-(furan-2-yl)-2-methyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one
Also Known As: BAS 12534651, 3-(4-fluorophenyl)-8-(furan-2-yl)-2-methyl-8,9-dihydropyrazolo[1,5-a]quinazolin-6(7H)-one, 3-(4-fluorophenyl)-8-(2-furyl)-2-methyl-7,8,9,10-tetrahydropyrazolo[1,5-a]quin azolin-6-one, 3-(4-FLUOROPHENYL)-8-(FURAN-2-YL)-2-METHYL-6H,7H,8H,9H-PYRAZOLO[1,5-A]QUINAZOLIN-6-ONE, 3-(4-fluorophenyl)-8-(furan-2-yl)-2-methyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one
| Molecular Formula | C21H16FN3O2 |
|---|---|
| Molecular Weight | 361.12 g/mol |
| LogP | 4.34952 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.12265 |
| Heavy Atoms | 27 |
| Complexity | 1160.5853 |
Chemical Identifiers
| CAS Number | 876668-30-3 |
|---|---|
| SMILES | CC1=NN2C3=C(C=NC2=C1C4=CC=C(C=C4)F)C(=O)CC(C3)C5=CC=CO5 |
Product Overview
BAS 12534651 (CAS 876668-30-3), with molecular formula C21H16FN3O2 and molecular weight 361.12 g/mol. IUPAC: 3-(4-fluorophenyl)-8-(furan-2-yl)-2-methyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one.
Chemical Property Profile of BAS 12534651
Property Insights of BAS 12534651
The XLogP value of 4.34952 indicates that BAS 12534651 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12534651. Following Lipinski's Rule of Five, BAS 12534651 has 0 hydrogen bond donor(s) and 4 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 12534651?
The CAS number of BAS 12534651 is 876668-30-3.
What is the molecular formula of BAS 12534651?
The molecular formula of BAS 12534651 is C21H16FN3O2.
What is the molecular weight of BAS 12534651?
The molecular weight of BAS 12534651 is 361.12 g/mol.
Where can I buy BAS 12534651?
You can request a quote for BAS 12534651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12534651?
Yes, KEHONG BIO provides custom synthesis services for BAS 12534651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.