![2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid structure](/static/products/1031/1031899-35-0.webp)
2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid
TL;DR: 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid (CAS 1031899-35-0) is a chemical compound with molecular formula C15H22N4O5 and molecular weight 338.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid
Also Known As: 2-[3-(dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid, 2-((3-(dimethylamino)propyl)amino)-4-((3-nitrophenyl)amino)-4-oxobutanoic acid, F1278-0444, 2-{[3-(DIMETHYLAMINO)PROPYL]AMINO}-3-[(3-NITROPHENYL)CARBAMOYL]PROPANOIC ACID, 2-{[3-(dimethylamino)propyl]amino}-3-[N-(3-nitrophenyl)carbamoyl]propanoic aci d
| Molecular Formula | C15H22N4O5 |
|---|---|
| Molecular Weight | 338.16 g/mol |
| LogP | 0.9179 |
| Topological Polar Surface Area | 124.81 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 338.15903 |
| Heavy Atoms | 24 |
| Complexity | 590.98206 |
Chemical Identifiers
| CAS Number | 1031899-35-0 |
|---|---|
| SMILES | CN(C)CCCNC(CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O |
Product Overview
2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid (CAS 1031899-35-0), with molecular formula C15H22N4O5 and molecular weight 338.16 g/mol. IUPAC: 2-[3-(dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid.
Chemical Property Profile of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid
Property Insights of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid
The XLogP value of 0.9179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid. The TPSA of 124.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid has 3 hydrogen bond donor(s) and 6 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-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid?
The CAS number of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid is 1031899-35-0.
What is the molecular formula of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid?
The molecular formula of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid is C15H22N4O5.
What is the molecular weight of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid?
The molecular weight of 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid is 338.16 g/mol.
Where can I buy 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid?
You can request a quote for 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(Dimethylamino)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.