BAS 00664233
TL;DR: BAS 00664233 (CAS 306732-59-2) is a chemical compound with molecular formula C17H13N3O6 and molecular weight 355.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: BAS 00664233, A0381/0017498, 1,3-dimethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-Dimethyl-5-[5-(4-nitro-phenyl)-furan-2-ylmethylene]-pyrimidine-2,4,6-trione, 5-[(5-{4-nitrophenyl}-2-furyl)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C17H13N3O6 |
|---|---|
| Molecular Weight | 355.08 g/mol |
| LogP | 2.2886 |
| Topological Polar Surface Area | 113.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.08044 |
| Heavy Atoms | 26 |
| Complexity | 931.13275 |
Chemical Identifiers
| CAS Number | 306732-59-2 |
|---|---|
| SMILES | CN1C(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N(C1=O)C |
Product Overview
BAS 00664233 (CAS 306732-59-2), with molecular formula C17H13N3O6 and molecular weight 355.08 g/mol. IUPAC: 1,3-dimethyl-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of BAS 00664233
Property Insights of BAS 00664233
The XLogP value of 2.2886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00664233. The TPSA of 113.97 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00664233. Following Lipinski's Rule of Five, BAS 00664233 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 BAS 00664233?
The CAS number of BAS 00664233 is 306732-59-2.
What is the molecular formula of BAS 00664233?
The molecular formula of BAS 00664233 is C17H13N3O6.
What is the molecular weight of BAS 00664233?
The molecular weight of BAS 00664233 is 355.08 g/mol.
Where can I buy BAS 00664233?
You can request a quote for BAS 00664233 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00664233?
Yes, KEHONG BIO provides custom synthesis services for BAS 00664233 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.