Glycine, N-(vanillylthiocarbamoyl)-, butyl ester
TL;DR: Glycine, N-(vanillylthiocarbamoyl)-, butyl ester (CAS 101516-99-8) is a chemical compound with molecular formula C15H22N2O4S and molecular weight 326.13004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl 2-[(4-hydroxy-3-methoxyphenyl)methylcarbamothioylamino]acetate
Also Known As: Glycine, N-(vanillylthiocarbamoyl)-, butyl ester, N-(Vanillylthiocarbamoyl)glycine butyl ester, 1-Carbobutoxymethyl-3-vanillyl-2-thiourea, butyl 2-[(4-hydroxy-3-methoxyphenyl)methylcarbamothioylamino]acetate, Glycine,N-[[[(4-hydroxy-3-methoxyphenyl)methyl]amino]thioxomethyl]-, butyl ester
Technical Specifications
| Molecular Formula | C15H22N2O4S |
| Molecular Weight | 326.13004 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 326.13004 Da |
| Heavy Atoms | 22 |
| Complexity | 354.0 |
| SMILES | CCCCOC(=O)CNC(=S)NCC1=CC(=C(C=C1)O)OC |
| InChIKey | COVOCBUNANFHCK-UHFFFAOYSA-N |
Chemical Property Profile of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester
Property Insights of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glycine, N-(vanillylthiocarbamoyl)-, butyl ester. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycine, N-(vanillylthiocarbamoyl)-, butyl ester. Following Lipinski's Rule of Five, Glycine, N-(vanillylthiocarbamoyl)-, butyl ester 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
What is the CAS number of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester?
The CAS number of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester is 101516-99-8.
What is the molecular formula of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester?
The molecular formula of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester is C15H22N2O4S.
What is the molecular weight of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester?
The molecular weight of Glycine, N-(vanillylthiocarbamoyl)-, butyl ester is 326.13004 g/mol.
Where can I buy Glycine, N-(vanillylthiocarbamoyl)-, butyl ester?
You can request a quote for Glycine, N-(vanillylthiocarbamoyl)-, butyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Glycine, N-(vanillylthiocarbamoyl)-, butyl ester?
Yes, CoreyChem provides custom synthesis services for Glycine, N-(vanillylthiocarbamoyl)-, butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.