4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid
TL;DR: 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid (CAS 893780-60-4) is a chemical compound with molecular formula C14H17NO3 and molecular weight 247.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid
Also Known As: 4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid, AO-080/43441854, A4146/0176646, 4-oxo-4-(5,6,7,8-tetrahydro-2-naphthalenylamino)butanoic acid, 3-(N-(2-5,6,7,8-tetrahydronaphthyl)carbamoyl)propanoic acid
| Molecular Formula | C14H17NO3 |
|---|---|
| Molecular Weight | 247.12 g/mol |
| LogP | 2.3687 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.12085 |
| Heavy Atoms | 18 |
| Complexity | 468.10696 |
Chemical Identifiers
| CAS Number | 893780-60-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)NC(=O)CCC(=O)O |
Product Overview
4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid (CAS 893780-60-4), with molecular formula C14H17NO3 and molecular weight 247.12 g/mol. IUPAC: 4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid.
Chemical Property Profile of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid
Property Insights of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid
The XLogP value of 2.3687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid. Following Lipinski's Rule of Five, 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid has 2 hydrogen bond donor(s) and 2 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-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid?
The CAS number of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid is 893780-60-4.
What is the molecular formula of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid?
The molecular formula of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid is C14H17NO3.
What is the molecular weight of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid?
The molecular weight of 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid is 247.12 g/mol.
Where can I buy 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid?
You can request a quote for 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-(5,6,7,8-tetrahydronaphthalen-2-ylamino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.