4-(4-Carboxybutanamido)benzoic acid
TL;DR: 4-(4-Carboxybutanamido)benzoic acid (CAS 140674-70-0) is a chemical compound with molecular formula C12H13NO5 and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-carboxybutanoylamino)benzoic acid
Also Known As: 4-(4-CARBOXYBUTANAMIDO)BENZOIC ACID, ChemDiv2_000709, 4-(4-carboxybutanoylamino)benzoic acid, 4-[(4-carboxybutanoyl)amino]benzoic acid, BIM-0016095.P001
| Molecular Formula | C12H13NO5 |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.07938 |
| Heavy Atoms | 18 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 140674-70-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)CCCC(=O)O |
| InChIKey | CEFSDBCGVOXJHW-UHFFFAOYSA-N |
Product Overview
4-(4-Carboxybutanamido)benzoic acid (CAS 140674-70-0), with molecular formula C12H13NO5 and molecular weight 251.08 g/mol. IUPAC: 4-(4-carboxybutanoylamino)benzoic acid.
Chemical Property Profile of 4-(4-Carboxybutanamido)benzoic acid
Property Insights of 4-(4-Carboxybutanamido)benzoic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Carboxybutanamido)benzoic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Carboxybutanamido)benzoic acid. Following Lipinski's Rule of Five, 4-(4-Carboxybutanamido)benzoic 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 4-(4-Carboxybutanamido)benzoic acid?
The CAS number of 4-(4-Carboxybutanamido)benzoic acid is 140674-70-0.
What is the molecular formula of 4-(4-Carboxybutanamido)benzoic acid?
The molecular formula of 4-(4-Carboxybutanamido)benzoic acid is C12H13NO5.
What is the molecular weight of 4-(4-Carboxybutanamido)benzoic acid?
The molecular weight of 4-(4-Carboxybutanamido)benzoic acid is 251.08 g/mol.
Where can I buy 4-(4-Carboxybutanamido)benzoic acid?
You can request a quote for 4-(4-Carboxybutanamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Carboxybutanamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Carboxybutanamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.