BIM-0033079.P001
TL;DR: BIM-0033079.P001 (CAS 299442-03-8) is a chemical compound with molecular formula C26H29N5OS and molecular weight 459.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2,2,6,6-tetramethylpiperidin-4-yl)iminomethyl]-1H-pyrazol-3-one
Also Known As: BIM-0033079.P001, 2-(1,3-benzothiazol-2-yl)-5-phenyl-4-{[(2,2,6,6-tetramethyl-4-piperidinyl)amino]methylene}-2,4-dihydro-3H-pyrazol-3-one, (4Z)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-{[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one, (E)-1-(benzo[d]thiazol-2-yl)-3-phenyl-4-(((2,2,6,6-tetramethylpiperidin-4-yl)amino)methylene)-1H-pyrazol-5(4H)-one, 2-(1,3-Benzothiazol-2-yl)-5-phenyl-4-[(2,2,6,6-tetramethylpiperidin-4-yl)iminomethyl]-1H-pyrazol-3-one
| Molecular Formula | C26H29N5OS |
|---|---|
| Molecular Weight | 459.21 g/mol |
| LogP | 5.1704 |
| Topological Polar Surface Area | 75.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.2093 |
| Heavy Atoms | 33 |
| Complexity | 1327.7053 |
Chemical Identifiers
| CAS Number | 299442-03-8 |
|---|---|
| SMILES | CC1(CC(CC(N1)(C)C)N=CC2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)C |
Product Overview
BIM-0033079.P001 (CAS 299442-03-8), with molecular formula C26H29N5OS and molecular weight 459.21 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[(2,2,6,6-tetramethylpiperidin-4-yl)iminomethyl]-1H-pyrazol-3-one.
Chemical Property Profile of BIM-0033079.P001
Property Insights of BIM-0033079.P001
The XLogP value of 5.1704 indicates that BIM-0033079.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0033079.P001. Following Lipinski's Rule of Five, BIM-0033079.P001 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 BIM-0033079.P001?
The CAS number of BIM-0033079.P001 is 299442-03-8.
What is the molecular formula of BIM-0033079.P001?
The molecular formula of BIM-0033079.P001 is C26H29N5OS.
What is the molecular weight of BIM-0033079.P001?
The molecular weight of BIM-0033079.P001 is 459.21 g/mol.
Where can I buy BIM-0033079.P001?
You can request a quote for BIM-0033079.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0033079.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0033079.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.