Narasimhan, B.; Ansari, A.M.; Singh, N.; Mourya, V.; Dhakee, A.S. A QSAR Approach for the Prediction of Stability of Benzoglycolamide Ester Prodrugs. Chem. Pharm. Bull. 2006, 54, 1067–1071.
Compound
| ID: | 27 | |
|---|---|---|
| Name: | [(azepan-1-yl)carbamoyl]methyl benzoate | |
| Description: | Names and InChI codes were generated with JChem for Excel | |
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C15H20N2O3/c18-14(16-17-10-6-1-2-7-11-17)12-20-15(19)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2,(H,16,18) |
Properties
logK: Hydrolytic rate constant as logK
| Value | Source or prediction |
|---|---|
| -1.09 |
experimental value |
| -1.22 |
Tab4.model3: Model for benzoglycolamide ester prodrugs (Training set) |