![3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid structure](/static/products/1103/110358-59-3.webp)
3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid
TL;DR: 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid (CAS 110358-59-3) is a chemical compound with molecular formula C10H10N4O7 and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobutanoic acid
Also Known As: BAS 01052626, 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid, 4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobutanoic acid, 3-[N'-(2,4-DINITROPHENYL)HYDRAZINECARBONYL]PROPANOIC ACID, F0358-0046
| Molecular Formula | C10H10N4O7 |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 0.8109 |
| Topological Polar Surface Area | 164.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 298.05496 |
| Heavy Atoms | 21 |
| Complexity | 601.06903 |
Chemical Identifiers
| CAS Number | 110358-59-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NNC(=O)CCC(=O)O |
Product Overview
3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid (CAS 110358-59-3), with molecular formula C10H10N4O7 and molecular weight 298.05 g/mol. IUPAC: 4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobutanoic acid.
Chemical Property Profile of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid
Property Insights of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid
The XLogP value of 0.8109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid. The TPSA of 164.71 Ų indicates high polarity, suggesting 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid has 3 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 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid?
The CAS number of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid is 110358-59-3.
What is the molecular formula of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid?
The molecular formula of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid is C10H10N4O7.
What is the molecular weight of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid?
The molecular weight of 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid is 298.05 g/mol.
Where can I buy 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid?
You can request a quote for 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{N-[(2,4-dinitrophenyl)amino]carbamoyl}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.