BIM-0009844.P001
TL;DR: BIM-0009844.P001 (CAS 394237-12-8) is a chemical compound with molecular formula C19H16ClN3O4S and molecular weight 417.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenoxy)-1-[3,5-dimethyl-4-(2-nitrophenyl)sulfanylpyrazol-1-yl]ethanone
Also Known As: BIM-0009844.P001, 2-(4-chlorophenoxy)-1-{3,5-dimethyl-4-[(2-nitrophenyl)sulfanyl]-1H-pyrazol-1-yl}ethan-1-one, F0755-0147, 1-((4-CHLOROPHENOXY)ACETYL)-3,5-DIMETHYL-4-((2-NITROPHENYL)THIO)-1H-PYRAZOLE, 2-(4-chlorophenoxy)-1-[3,5-dimethyl-4-(2-nitrophenyl)sulfanylpyrazol-1-yl]ethanone
| Molecular Formula | C19H16ClN3O4S |
|---|---|
| Molecular Weight | 417.06 g/mol |
| LogP | 4.93194 |
| Topological Polar Surface Area | 87.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.055 |
| Heavy Atoms | 28 |
| Complexity | 1034.1581 |
Chemical Identifiers
| CAS Number | 394237-12-8 |
|---|---|
| SMILES | CC1=C(C(=NN1C(=O)COC2=CC=C(C=C2)Cl)C)SC3=CC=CC=C3[N+](=O)[O-] |
Product Overview
BIM-0009844.P001 (CAS 394237-12-8), with molecular formula C19H16ClN3O4S and molecular weight 417.06 g/mol. IUPAC: 2-(4-chlorophenoxy)-1-[3,5-dimethyl-4-(2-nitrophenyl)sulfanylpyrazol-1-yl]ethanone.
Chemical Property Profile of BIM-0009844.P001
Property Insights of BIM-0009844.P001
The XLogP value of 4.93194 indicates that BIM-0009844.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.26 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0009844.P001. Following Lipinski's Rule of Five, BIM-0009844.P001 has 0 hydrogen bond donor(s) and 6 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 BIM-0009844.P001?
The CAS number of BIM-0009844.P001 is 394237-12-8.
What is the molecular formula of BIM-0009844.P001?
The molecular formula of BIM-0009844.P001 is C19H16ClN3O4S.
What is the molecular weight of BIM-0009844.P001?
The molecular weight of BIM-0009844.P001 is 417.06 g/mol.
Where can I buy BIM-0009844.P001?
You can request a quote for BIM-0009844.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0009844.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0009844.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.