1,3-Bis[(2-nitrophenyl)methylideneamino]urea
TL;DR: 1,3-Bis[(2-nitrophenyl)methylideneamino]urea (CAS 26213-68-3) is a chemical compound with molecular formula C15H12N6O5 and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis[(2-nitrophenyl)methylideneamino]urea
Also Known As: 1,3-bis[(2-nitrophenyl)methylideneamino]urea, 1,3-bis[(E)-(2-nitrophenyl)methylideneamino]urea, Carbonic dihydrazide,bis[(2-nitrophenyl)methylene]- (9CI), N',2-Bis[(2-nitrophenyl)methylidene]hydrazine-1-carbohydrazide
| Molecular Formula | C15H12N6O5 |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.0869 |
| Heavy Atoms | 26 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 26213-68-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NNC(=O)NN=CC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | XALPGYJENPARFS-UHFFFAOYSA-N |
Product Overview
1,3-Bis[(2-nitrophenyl)methylideneamino]urea (CAS 26213-68-3), with molecular formula C15H12N6O5 and molecular weight 356.09 g/mol. IUPAC: 1,3-bis[(2-nitrophenyl)methylideneamino]urea.
Chemical Property Profile of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea
Property Insights of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis[(2-nitrophenyl)methylideneamino]urea. The TPSA of 157.0 Ų indicates high polarity, suggesting 1,3-Bis[(2-nitrophenyl)methylideneamino]urea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Bis[(2-nitrophenyl)methylideneamino]urea has 2 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 1,3-Bis[(2-nitrophenyl)methylideneamino]urea?
The CAS number of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea is 26213-68-3.
What is the molecular formula of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea?
The molecular formula of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea is C15H12N6O5.
What is the molecular weight of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea?
The molecular weight of 1,3-Bis[(2-nitrophenyl)methylideneamino]urea is 356.09 g/mol.
Where can I buy 1,3-Bis[(2-nitrophenyl)methylideneamino]urea?
You can request a quote for 1,3-Bis[(2-nitrophenyl)methylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis[(2-nitrophenyl)methylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis[(2-nitrophenyl)methylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.