BAS 01841187
TL;DR: BAS 01841187 (CAS 332853-57-3) is a chemical compound with molecular formula C23H20F3N5OS and molecular weight 471.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: BAS 01841187, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C23H20F3N5OS |
|---|---|
| Molecular Weight | 471.13 g/mol |
| LogP | 5.60768 |
| Topological Polar Surface Area | 82.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.13406 |
| Heavy Atoms | 33 |
| Complexity | 1241.5059 |
Chemical Identifiers
| CAS Number | 332853-57-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C4NC(CC(N4N=C3)C(F)(F)F)C5=CC=CC=C5)C#N |
Product Overview
BAS 01841187 (CAS 332853-57-3), with molecular formula C23H20F3N5OS and molecular weight 471.13 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of BAS 01841187
Property Insights of BAS 01841187
The XLogP value of 5.60768 indicates that BAS 01841187 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01841187. Following Lipinski's Rule of Five, BAS 01841187 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01841187?
The CAS number of BAS 01841187 is 332853-57-3.
What is the molecular formula of BAS 01841187?
The molecular formula of BAS 01841187 is C23H20F3N5OS.
What is the molecular weight of BAS 01841187?
The molecular weight of BAS 01841187 is 471.13 g/mol.
Where can I buy BAS 01841187?
You can request a quote for BAS 01841187 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01841187?
Yes, KEHONG BIO provides custom synthesis services for BAS 01841187 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.