RefChem:326579
TL;DR: RefChem:326579 (CAS 93799-11-2) is a chemical compound with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(2,2,5,5-tetramethyl-1H-pyrrole-3-carbonyl)amino]ethylcarbamoyl]benzoic acid
Also Known As: Benzoic acid, 2-(((2-(((2,5-dihydro-2,2,5,5-tetramethyl-1H-pyrrol-3-yl)carbonyl)amino)ethyl)amino)carbonyl)-, 2-[2-[(2,2,5,5-tetramethyl-1H-pyrrole-3-carbonyl)amino]ethylcarbamoyl]benzoic acid, 2-{[2-(2,2,5,5-Tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxamido)ethyl]carbamoyl}benzoic acid, BRN 5994647, RefChem:326579
| Molecular Formula | C19H25N3O4 |
|---|---|
| Molecular Weight | 359.18 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.1845 |
| Heavy Atoms | 26 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 93799-11-2 |
|---|---|
| SMILES | CC1(C=C(C(N1)(C)C)C(=O)NCCNC(=O)C2=CC=CC=C2C(=O)O)C |
| InChIKey | SBHMFOZIJMWLMK-UHFFFAOYSA-N |
Product Overview
RefChem:326579 (CAS 93799-11-2), with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol. IUPAC: 2-[2-[(2,2,5,5-tetramethyl-1H-pyrrole-3-carbonyl)amino]ethylcarbamoyl]benzoic acid.
Chemical Property Profile of RefChem:326579
Property Insights of RefChem:326579
The XLogP value of -1.6 indicates that RefChem:326579 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:326579. Following Lipinski's Rule of Five, RefChem:326579 has 4 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 RefChem:326579?
The CAS number of RefChem:326579 is 93799-11-2.
What is the molecular formula of RefChem:326579?
The molecular formula of RefChem:326579 is C19H25N3O4.
What is the molecular weight of RefChem:326579?
The molecular weight of RefChem:326579 is 359.18 g/mol.
Where can I buy RefChem:326579?
You can request a quote for RefChem:326579 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326579?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326579 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.