![2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid structure](/static/products/1031/1031257-38-1.webp)
2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid
TL;DR: 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid (CAS 1031257-38-1) is a chemical compound with molecular formula C12H15N3O5 and molecular weight 281.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(ethylamino)-4-(3-nitroanilino)-4-oxobutanoic acid
Also Known As: SDCCGMLS-0065744.P001, 2-(ETHYLAMINO)-3-[(3-NITROPHENYL)CARBAMOYL]PROPANOIC ACID, 2-(ethylamino)-4-(3-nitroanilino)-4-oxobutanoic acid, F2721-0161, 2-(ethylamino)-3-[N-(3-nitrophenyl)carbamoyl]propanoic acid
| Molecular Formula | C12H15N3O5 |
|---|---|
| Molecular Weight | 281.10 g/mol |
| LogP | 0.9861 |
| Topological Polar Surface Area | 121.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 281.10117 |
| Heavy Atoms | 20 |
| Complexity | 517.5692 |
Chemical Identifiers
| CAS Number | 1031257-38-1 |
|---|---|
| SMILES | CCNC(CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O |
Product Overview
2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid (CAS 1031257-38-1), with molecular formula C12H15N3O5 and molecular weight 281.10 g/mol. IUPAC: 2-(ethylamino)-4-(3-nitroanilino)-4-oxobutanoic acid.
Chemical Property Profile of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid
Property Insights of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid
The XLogP value of 0.9861 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid. The TPSA of 121.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid. Following Lipinski's Rule of Five, 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid has 3 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 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid?
The CAS number of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid is 1031257-38-1.
What is the molecular formula of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid?
The molecular formula of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid is C12H15N3O5.
What is the molecular weight of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid?
The molecular weight of 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid is 281.10 g/mol.
Where can I buy 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid?
You can request a quote for 2-(Ethylamino)-3-[(3-nitrophenyl)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 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethylamino)-3-[(3-nitrophenyl)carbamoyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.