BAS 00924139
TL;DR: BAS 00924139 (CAS 355805-17-3) is a chemical compound with molecular formula C15H15BrN4O3 and molecular weight 378.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone
Also Known As: BAS 00924139, 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone, 2-({4-bromo-3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)-1,2,3,4-tetrahydroisoquinoline, 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone, 2-(4-Bromo-5-methyl-3-nitro-pyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-ethanone
| Molecular Formula | C15H15BrN4O3 |
|---|---|
| Molecular Weight | 378.03 g/mol |
| LogP | 2.44712 |
| Topological Polar Surface Area | 81.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.03275 |
| Heavy Atoms | 23 |
| Complexity | 787.02435 |
Chemical Identifiers
| CAS Number | 355805-17-3 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-])Br |
Product Overview
BAS 00924139 (CAS 355805-17-3), with molecular formula C15H15BrN4O3 and molecular weight 378.03 g/mol. IUPAC: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone.
Chemical Property Profile of BAS 00924139
Property Insights of BAS 00924139
The XLogP value of 2.44712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00924139. The TPSA of 81.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00924139. Following Lipinski's Rule of Five, BAS 00924139 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 00924139?
The CAS number of BAS 00924139 is 355805-17-3.
What is the molecular formula of BAS 00924139?
The molecular formula of BAS 00924139 is C15H15BrN4O3.
What is the molecular weight of BAS 00924139?
The molecular weight of BAS 00924139 is 378.03 g/mol.
Where can I buy BAS 00924139?
You can request a quote for BAS 00924139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00924139?
Yes, KEHONG BIO provides custom synthesis services for BAS 00924139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.