BAS 01841113
TL;DR: BAS 01841113 (CAS 357293-39-1) is a chemical compound with molecular formula C19H22ClF3N4OS and molecular weight 446.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-(2,6-dimethylpiperidin-1-yl)methanone
Also Known As: BAS 01841113, BIM-0011674.P001, (3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl)(2,6-dimethylpiperidin-1-yl)methanone, [3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethylpiperidin-1-yl)methanone, [3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-(2,6-dimethylpiperidin-1-yl)methanone
| Molecular Formula | C19H22ClF3N4OS |
|---|---|
| Molecular Weight | 446.12 g/mol |
| LogP | 5.6614 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 446.1155 |
| Heavy Atoms | 29 |
| Complexity | 888.14667 |
Chemical Identifiers
| CAS Number | 357293-39-1 |
|---|---|
| SMILES | CC1CCCC(N1C(=O)C2=NN3C(CC(NC3=C2Cl)C4=CC=CS4)C(F)(F)F)C |
Product Overview
BAS 01841113 (CAS 357293-39-1), with molecular formula C19H22ClF3N4OS and molecular weight 446.12 g/mol. IUPAC: [3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]-(2,6-dimethylpiperidin-1-yl)methanone.
Chemical Property Profile of BAS 01841113
Property Insights of BAS 01841113
The XLogP value of 5.6614 indicates that BAS 01841113 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.16 Ų, BAS 01841113 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01841113 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01841113?
The CAS number of BAS 01841113 is 357293-39-1.
What is the molecular formula of BAS 01841113?
The molecular formula of BAS 01841113 is C19H22ClF3N4OS.
What is the molecular weight of BAS 01841113?
The molecular weight of BAS 01841113 is 446.12 g/mol.
Where can I buy BAS 01841113?
You can request a quote for BAS 01841113 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01841113?
Yes, KEHONG BIO provides custom synthesis services for BAS 01841113 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.