RefChem:331298
TL;DR: RefChem:331298 (CAS 81186-18-7) is a chemical compound with molecular formula C19H28N4O4 and molecular weight 376.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(1-hydroxybutyl)amino]methyl]amino]butanoic acid
Also Known As: 4-(Benzoyl(((4,5-dihydro-1H-imidazol-2-yl)(1-hydroxybutyl)amino)methyl)amino)butyric acid, Butyric acid, 4-(benzoyl(((4,5-dihydro-1H-imidazol-2-yl)(1-hydroxybutyl)amino)methyl)amino)-, 4-[Benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(1-hydroxybutyl)amino]methyl]amino]butanoicacid, 4-(Benzoyl{[(4,5-dihydro-1H-imidazol-2-yl)(1-hydroxybutyl)amino]methyl}amino)butanoic acid, 4-(N-{[(4,5-Dihydro-1H-imidazol-2-yl)(1-hydroxybutyl)amino]methyl}benzamido)butanoic acid
| Molecular Formula | C19H28N4O4 |
|---|---|
| Molecular Weight | 376.21 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 376.21106 |
| Heavy Atoms | 27 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 81186-18-7 |
|---|---|
| SMILES | CCCC(N(CN(CCCC(=O)O)C(=O)C1=CC=CC=C1)C2=NCCN2)O |
| InChIKey | GARHORUDOLGIOA-UHFFFAOYSA-N |
Product Overview
RefChem:331298 (CAS 81186-18-7), with molecular formula C19H28N4O4 and molecular weight 376.21 g/mol. IUPAC: 4-[benzoyl-[[4,5-dihydro-1H-imidazol-2-yl(1-hydroxybutyl)amino]methyl]amino]butanoic acid.
Chemical Property Profile of RefChem:331298
Property Insights of RefChem:331298
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:331298. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:331298. Following Lipinski's Rule of Five, RefChem:331298 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 RefChem:331298?
The CAS number of RefChem:331298 is 81186-18-7.
What is the molecular formula of RefChem:331298?
The molecular formula of RefChem:331298 is C19H28N4O4.
What is the molecular weight of RefChem:331298?
The molecular weight of RefChem:331298 is 376.21 g/mol.
Where can I buy RefChem:331298?
You can request a quote for RefChem:331298 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:331298?
Yes, KEHONG BIO provides custom synthesis services for RefChem:331298 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.