N-(benzylcarbamoyl)-L-valine
TL;DR: N-(benzylcarbamoyl)-L-valine (CAS 1173661-64-7) is a chemical compound with molecular formula C13H18N2O3 and molecular weight 250.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(benzylcarbamoylamino)-3-methylbutanoic acid
Also Known As: N-(benzylcarbamoyl)-L-valine, (S)-2-(3-benzylureido)-3-methylbutanoic acid, 2-(benzylcarbamoylamino)-3-methyl-butanoic Acid, (2S)-2-(benzylcarbamoylamino)-3-methylbutanoic acid
Technical Specifications
| Molecular Formula | C13H18N2O3 |
| Molecular Weight | 250.13174 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.13174 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)NCC1=CC=CC=C1 |
| InChIKey | GXXOANOVALAKPV-NSHDSACASA-N |
Chemical Property Profile of N-(benzylcarbamoyl)-L-valine
Property Insights of N-(benzylcarbamoyl)-L-valine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(benzylcarbamoyl)-L-valine. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(benzylcarbamoyl)-L-valine. Following Lipinski's Rule of Five, N-(benzylcarbamoyl)-L-valine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(benzylcarbamoyl)-L-valine?
The CAS number of N-(benzylcarbamoyl)-L-valine is 1173661-64-7.
What is the molecular formula of N-(benzylcarbamoyl)-L-valine?
The molecular formula of N-(benzylcarbamoyl)-L-valine is C13H18N2O3.
What is the molecular weight of N-(benzylcarbamoyl)-L-valine?
The molecular weight of N-(benzylcarbamoyl)-L-valine is 250.13174 g/mol.
Where can I buy N-(benzylcarbamoyl)-L-valine?
You can request a quote for N-(benzylcarbamoyl)-L-valine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(benzylcarbamoyl)-L-valine?
Yes, CoreyChem provides custom synthesis services for N-(benzylcarbamoyl)-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.