BAS 13474590
TL;DR: BAS 13474590 (CAS 727683-32-1) is a chemical compound with molecular formula C19H14ClN3O3 and molecular weight 367.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-2,4,5,7-tetrahydropyrazolo[3,4-b]pyridin-6-one
Also Known As: BAS 13474590, A3790/0160929, 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one, 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one, 4-(2H-1,3-BENZODIOXOL-5-YL)-3-(4-CHLOROPHENYL)-1H,4H,5H,6H,7H-PYRAZOLO[3,4-B]PYRIDIN-6-ONE
| Molecular Formula | C19H14ClN3O3 |
|---|---|
| Molecular Weight | 367.07 g/mol |
| LogP | 3.9329 |
| Topological Polar Surface Area | 76.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 367.07236 |
| Heavy Atoms | 26 |
| Complexity | 1013.36884 |
Chemical Identifiers
| CAS Number | 727683-32-1 |
|---|---|
| SMILES | C1C(C2=C(NN=C2NC1=O)C3=CC=C(C=C3)Cl)C4=CC5=C(C=C4)OCO5 |
Product Overview
BAS 13474590 (CAS 727683-32-1), with molecular formula C19H14ClN3O3 and molecular weight 367.07 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-2,4,5,7-tetrahydropyrazolo[3,4-b]pyridin-6-one.
Chemical Property Profile of BAS 13474590
Property Insights of BAS 13474590
The XLogP value of 3.9329 indicates that BAS 13474590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13474590. Following Lipinski's Rule of Five, BAS 13474590 has 2 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 13474590?
The CAS number of BAS 13474590 is 727683-32-1.
What is the molecular formula of BAS 13474590?
The molecular formula of BAS 13474590 is C19H14ClN3O3.
What is the molecular weight of BAS 13474590?
The molecular weight of BAS 13474590 is 367.07 g/mol.
Where can I buy BAS 13474590?
You can request a quote for BAS 13474590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13474590?
Yes, KEHONG BIO provides custom synthesis services for BAS 13474590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.