F1001-0044
TL;DR: F1001-0044 (CAS 328017-22-7) is a chemical compound with molecular formula C16H12BrN5O3S and molecular weight 432.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole
Also Known As: F1001-0044, 2-(((3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl)thio)-5-nitrobenzo[d]oxazole, 2-[({3-BROMO-5,7-DIMETHYLIMIDAZO[1,2-A]PYRIMIDIN-2-YL}METHYL)SULFANYL]-5-NITRO-1,3-BENZOXAZOLE, 2-[(3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole, 2-[(3-bromo-5,7-dimethyl(4-hydroimidazo[1,2-a]pyrimidin-2-yl))methylthio]-5-ni trobenzoxazole
| Molecular Formula | C16H12BrN5O3S |
|---|---|
| Molecular Weight | 432.98 g/mol |
| LogP | 4.45034 |
| Topological Polar Surface Area | 99.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.9844 |
| Heavy Atoms | 26 |
| Complexity | 1169.8252 |
Chemical Identifiers
| CAS Number | 328017-22-7 |
|---|---|
| SMILES | CC1=CC(=NC2=NC(=C(N12)Br)CSC3=NC4=C(O3)C=CC(=C4)[N+](=O)[O-])C |
Product Overview
F1001-0044 (CAS 328017-22-7), with molecular formula C16H12BrN5O3S and molecular weight 432.98 g/mol. IUPAC: 2-[(3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-5-nitro-1,3-benzoxazole.
Chemical Property Profile of F1001-0044
Property Insights of F1001-0044
The XLogP value of 4.45034 indicates that F1001-0044 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.36 Ų falls within the moderate polarity range, balancing permeability and solubility for F1001-0044. Following Lipinski's Rule of Five, F1001-0044 has 0 hydrogen bond donor(s) and 7 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 F1001-0044?
The CAS number of F1001-0044 is 328017-22-7.
What is the molecular formula of F1001-0044?
The molecular formula of F1001-0044 is C16H12BrN5O3S.
What is the molecular weight of F1001-0044?
The molecular weight of F1001-0044 is 432.98 g/mol.
Where can I buy F1001-0044?
You can request a quote for F1001-0044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1001-0044?
Yes, KEHONG BIO provides custom synthesis services for F1001-0044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.