3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid
TL;DR: 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid (CAS 293761-46-3) is a chemical compound with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(3-carboxypropanoylamino)naphthalen-1-yl]amino]-4-oxobutanoic acid
Also Known As: BAS 00821030, 4,4'-(naphthalene-1,5-diyldiimino)bis(4-oxobutanoic acid), Butanoicacid,4,4'-(1,5-naphthalenediyldiimino) bis[4-oxo-], 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid, 4,4'-(naphthalene-1,5-diylbis(azanediyl))bis(4-oxobutanoic acid)
| Molecular Formula | C18H18N2O6 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 2.4464 |
| Topological Polar Surface Area | 132.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 358.1165 |
| Heavy Atoms | 26 |
| Complexity | 790.6302 |
Chemical Identifiers
| CAS Number | 293761-46-3 |
|---|---|
| SMILES | C1=CC2=C(C=CC=C2NC(=O)CCC(=O)O)C(=C1)NC(=O)CCC(=O)O |
Product Overview
3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid (CAS 293761-46-3), with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol. IUPAC: 4-[[5-(3-carboxypropanoylamino)naphthalen-1-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid
Property Insights of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid
The XLogP value of 2.4464 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid. The TPSA of 132.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid. Following Lipinski's Rule of Five, 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid has 4 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 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid?
The CAS number of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid is 293761-46-3.
What is the molecular formula of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid?
The molecular formula of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid is C18H18N2O6.
What is the molecular weight of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid?
The molecular weight of 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid is 358.12 g/mol.
Where can I buy 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid?
You can request a quote for 3-{N-[5-(3-carboxypropanoylamino)naphthyl]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-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{N-[5-(3-carboxypropanoylamino)naphthyl]carbamoyl}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.