BAS 01841022
TL;DR: BAS 01841022 (CAS 332852-30-9) is a chemical compound with molecular formula C16H16BrF3N4O2S and molecular weight 464.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-bromo-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone
Also Known As: BAS 01841022, BIM-0012650.P001, (3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl)(morpholino)methanone, [3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](morpholin-4-yl)methanone, [3-bromo-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone
| Molecular Formula | C16H16BrF3N4O2S |
|---|---|
| Molecular Weight | 464.01 g/mol |
| LogP | 3.8398 |
| Topological Polar Surface Area | 59.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 464.01294 |
| Heavy Atoms | 27 |
| Complexity | 833.5792 |
Chemical Identifiers
| CAS Number | 332852-30-9 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=NN3C(CC(NC3=C2Br)C4=CC=CS4)C(F)(F)F |
Product Overview
BAS 01841022 (CAS 332852-30-9), with molecular formula C16H16BrF3N4O2S and molecular weight 464.01 g/mol. IUPAC: [3-bromo-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone.
Chemical Property Profile of BAS 01841022
Property Insights of BAS 01841022
The XLogP value of 3.8398 indicates that BAS 01841022 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.39 Ų, BAS 01841022 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01841022 has 1 hydrogen bond donor(s) and 5 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 01841022?
The CAS number of BAS 01841022 is 332852-30-9.
What is the molecular formula of BAS 01841022?
The molecular formula of BAS 01841022 is C16H16BrF3N4O2S.
What is the molecular weight of BAS 01841022?
The molecular weight of BAS 01841022 is 464.01 g/mol.
Where can I buy BAS 01841022?
You can request a quote for BAS 01841022 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01841022?
Yes, KEHONG BIO provides custom synthesis services for BAS 01841022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.