![6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione structure](/static/products/294/294194-80-2.png)
6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
TL;DR: 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 294194-80-2) is a chemical compound with molecular formula C15H13N5O5 and molecular weight 343.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
Also Known As: 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione, 5-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one, 6-[(E)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione, (E)-6-(2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-5-yl)vinyl)-5-nitropyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C15H13N5O5 |
|---|---|
| Molecular Weight | 343.09 g/mol |
| LogP | 0.3322 |
| Topological Polar Surface Area | 135.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.09167 |
| Heavy Atoms | 25 |
| Complexity | 1207.7458 |
Chemical Identifiers
| CAS Number | 294194-80-2 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)/C=C/C3=C(C(=O)NC(=O)N3)[N+](=O)[O-])N(C1=O)C |
Product Overview
6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 294194-80-2), with molecular formula C15H13N5O5 and molecular weight 343.09 g/mol. IUPAC: 6-[(E)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Property Insights of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.3322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione. The TPSA of 135.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione has 2 hydrogen bond donor(s) and 5 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 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione is 294194-80-2.
What is the molecular formula of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione is C15H13N5O5.
What is the molecular weight of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione is 343.09 g/mol.
Where can I buy 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[(E)-2-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.