![[4-(4-Nitrophenyl)butan-2-ylideneamino]urea structure](/static/products/3506/3506-83-0.webp)
[4-(4-Nitrophenyl)butan-2-ylideneamino]urea
TL;DR: [4-(4-Nitrophenyl)butan-2-ylideneamino]urea (CAS 3506-83-0) is a chemical compound with molecular formula C11H14N4O3 and molecular weight 250.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-nitrophenyl)butan-2-ylideneamino]urea
Also Known As: [4-(4-nitrophenyl)butan-2-ylideneamino]urea|[(E)-4-(4-nitrophenyl)butan-2-ylideneamino]urea
| Molecular Formula | C11H14N4O3 |
|---|---|
| Molecular Weight | 250.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.1066 |
| Heavy Atoms | 18 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 3506-83-0 |
|---|---|
| SMILES | CC(=NNC(=O)N)CCC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | ROYGAIJYLCJHEP-UHFFFAOYSA-N |
Product Overview
[4-(4-Nitrophenyl)butan-2-ylideneamino]urea (CAS 3506-83-0), with molecular formula C11H14N4O3 and molecular weight 250.11 g/mol. IUPAC: [4-(4-nitrophenyl)butan-2-ylideneamino]urea.
Chemical Property Profile of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea
Property Insights of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(4-Nitrophenyl)butan-2-ylideneamino]urea. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(4-Nitrophenyl)butan-2-ylideneamino]urea. Following Lipinski's Rule of Five, [4-(4-Nitrophenyl)butan-2-ylideneamino]urea has 2 hydrogen bond donor(s) and 4 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 [4-(4-Nitrophenyl)butan-2-ylideneamino]urea?
The CAS number of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea is 3506-83-0.
What is the molecular formula of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea?
The molecular formula of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea is C11H14N4O3.
What is the molecular weight of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea?
The molecular weight of [4-(4-Nitrophenyl)butan-2-ylideneamino]urea is 250.11 g/mol.
Where can I buy [4-(4-Nitrophenyl)butan-2-ylideneamino]urea?
You can request a quote for [4-(4-Nitrophenyl)butan-2-ylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-Nitrophenyl)butan-2-ylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Nitrophenyl)butan-2-ylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.