BIM-0001293.P001
TL;DR: BIM-0001293.P001 (CAS 401635-34-5) is a chemical compound with molecular formula C27H23FN6O2S and molecular weight 514.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BIM-0001293.P001, A2660/0113398, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-((5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C27H23FN6O2S |
|---|---|
| Molecular Weight | 514.16 g/mol |
| LogP | 4.60202 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 514.15875 |
| Heavy Atoms | 37 |
| Complexity | 1626.1735 |
Chemical Identifiers
| CAS Number | 401635-34-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC(=CC=C5)F |
Product Overview
BIM-0001293.P001 (CAS 401635-34-5), with molecular formula C27H23FN6O2S and molecular weight 514.16 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BIM-0001293.P001
Property Insights of BIM-0001293.P001
The XLogP value of 4.60202 indicates that BIM-0001293.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0001293.P001. Following Lipinski's Rule of Five, BIM-0001293.P001 has 1 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-0001293.P001?
The CAS number of BIM-0001293.P001 is 401635-34-5.
What is the molecular formula of BIM-0001293.P001?
The molecular formula of BIM-0001293.P001 is C27H23FN6O2S.
What is the molecular weight of BIM-0001293.P001?
The molecular weight of BIM-0001293.P001 is 514.16 g/mol.
Where can I buy BIM-0001293.P001?
You can request a quote for BIM-0001293.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0001293.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0001293.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.