KST-1B1288
TL;DR: KST-1B1288 (CAS 18813-64-4) is a chemical compound with molecular formula C14H12F3N5O5 and molecular weight 387.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6S)-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl]-3-[4-(trifluoromethoxy)phenyl]urea
Also Known As: KST-1B1288, 1-[(6s)-2-nitro-6,7-dihydro-5h-imidazo[2,1-b][1,3]oxazin-6-yl]-3-[4-(trifluoromethoxy)phenyl]urea, 1-((S)-2-Nitro-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazin-6-yl)-3-(4-trifluoromethoxy-phenyl)-urea, 1-((S)-2-Nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl)-3-(4-trifluoromethoxy-phenyl)-urea, N-[(6S)-2-Nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl]-N'-[4-(trifluoromethoxy)phenyl]urea
| Molecular Formula | C14H12F3N5O5 |
|---|---|
| Molecular Weight | 387.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.07904 |
| Heavy Atoms | 27 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 18813-64-4 |
|---|---|
| SMILES | C1[C@@H](COC2=NC(=CN21)[N+](=O)[O-])NC(=O)NC3=CC=C(C=C3)OC(F)(F)F |
| InChIKey | OOFRZDPLXWOZAD-VIFPVBQESA-N |
Product Overview
KST-1B1288 (CAS 18813-64-4), with molecular formula C14H12F3N5O5 and molecular weight 387.08 g/mol. IUPAC: 1-[(6S)-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl]-3-[4-(trifluoromethoxy)phenyl]urea.
Chemical Property Profile of KST-1B1288
Property Insights of KST-1B1288
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1B1288. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B1288. Following Lipinski's Rule of Five, KST-1B1288 has 2 hydrogen bond donor(s) and 9 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 KST-1B1288?
The CAS number of KST-1B1288 is 18813-64-4.
What is the molecular formula of KST-1B1288?
The molecular formula of KST-1B1288 is C14H12F3N5O5.
What is the molecular weight of KST-1B1288?
The molecular weight of KST-1B1288 is 387.08 g/mol.
Where can I buy KST-1B1288?
You can request a quote for KST-1B1288 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B1288?
Yes, KEHONG BIO provides custom synthesis services for KST-1B1288 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.