L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester
TL;DR: L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester (CAS 133526-79-1) is a chemical compound with molecular formula C16H21N5O3S and molecular weight 363.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2S)-3-methyl-2-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]butanoate
Also Known As: N-(((1-Phenyl-1H-tetrazol-5-yl)thio)acetyl)-L-valine ethyl ester, L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester, Ethyl N-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-L-valinate, ethyl (2S)-3-methyl-2-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]butanoate
Technical Specifications
| Molecular Formula | C16H21N5O3S |
| Molecular Weight | 363.1365 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 363.1365 Da |
| Heavy Atoms | 25 |
| Complexity | 445.0 |
| SMILES | CCOC(=O)[C@H](C(C)C)NC(=O)CSC1=NN=NN1C2=CC=CC=C2 |
| InChIKey | HTWDTLRUSPHBEA-AWEZNQCLSA-N |
Chemical Property Profile of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester
Property Insights of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester
The XLogP value of 3.1 indicates that L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester. Following Lipinski's Rule of Five, L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester?
The CAS number of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester is 133526-79-1.
What is the molecular formula of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester?
The molecular formula of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester is C16H21N5O3S.
What is the molecular weight of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester?
The molecular weight of L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester is 363.1365 g/mol.
Where can I buy L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester?
You can request a quote for L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for L-Valine, N-(((1-phenyl-1H-tetrazol-5-yl)thio)acetyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.