(S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid
TL;DR: (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid (CAS 1173678-64-2) is a chemical compound with molecular formula C14H20N2O4 and molecular weight 280.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(2-methoxyphenyl)methylcarbamoylamino]-3-methylbutanoic acid
Also Known As: (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid, 2-[(2-methoxyphenyl)methylcarbamoylamino]-3-methyl-butanoic Acid, (2S)-2-[(2-methoxyphenyl)methylcarbamoylamino]-3-methylbutanoic acid
Technical Specifications
| Molecular Formula | C14H20N2O4 |
| Molecular Weight | 280.1423 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 280.1423 Da |
| Heavy Atoms | 20 |
| Complexity | 333.0 |
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)NCC1=CC=CC=C1OC |
| InChIKey | PZLYDCLTRWEANV-LBPRGKRZSA-N |
Chemical Property Profile of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid
Property Insights of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid. Following Lipinski's Rule of Five, (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid?
The CAS number of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid is 1173678-64-2.
What is the molecular formula of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid?
The molecular formula of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid is C14H20N2O4.
What is the molecular weight of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid?
The molecular weight of (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid is 280.1423 g/mol.
Where can I buy (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid?
You can request a quote for (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for (S)-2-(3-(2-methoxybenzyl)ureido)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.