RefChem:237571
TL;DR: RefChem:237571 (CAS 141246-00-6) is a chemical compound with molecular formula C20H21N3O5 and molecular weight 383.14813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-[(4-ethoxyphenyl)methyl]-5-nitrobenzimidazol-1-yl]butanoic acid
Also Known As: 2-((4-Ethoxyphenyl)methyl)-beta-methyl-5-nitro-1H-benzimidazole-1-propanoic acid, 1H-Benzimidazole-1-propanoic acid, 2-((4-ethoxyphenyl)methyl)-beta-methyl-5-nitro-, 3-[2-[4-Ethoxybenzyl]-5-nitro-1H-benzimidazol-1-yl]butanoic acid, 3-[2-[(4-ethoxyphenyl)methyl]-5-nitrobenzimidazol-1-yl]butanoic acid, 3-{2-[(4-Ethoxyphenyl)methyl]-5-nitro-1H-benzimidazol-1-yl}butanoic acid
Technical Specifications
| Molecular Formula | C20H21N3O5 |
| Molecular Weight | 383.14813 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.14813 Da |
| Heavy Atoms | 28 |
| Complexity | 546.0 |
| SMILES | CCOC1=CC=C(C=C1)CC2=NC3=C(N2C(C)CC(=O)O)C=CC(=C3)[N+](=O)[O-] |
| InChIKey | ONDARZUHDLKPNL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:237571
Property Insights of RefChem:237571
The XLogP value of 3.4 indicates that RefChem:237571 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:237571. Following Lipinski's Rule of Five, RefChem:237571 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:237571?
The CAS number of RefChem:237571 is 141246-00-6.
What is the molecular formula of RefChem:237571?
The molecular formula of RefChem:237571 is C20H21N3O5.
What is the molecular weight of RefChem:237571?
The molecular weight of RefChem:237571 is 383.14813 g/mol.
Where can I buy RefChem:237571?
You can request a quote for RefChem:237571 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:237571?
Yes, CoreyChem provides custom synthesis services for RefChem:237571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.