N-tert-butyl-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-tert-butyl-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
N-tert-butyl-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D360-7017 |
| Compound Name: | N-tert-butyl-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 317.41 |
| Molecular Formula: | C16 H19 N3 O2 S |
| Smiles: | CC(C)(C)NC(CSc1c(C#N)cc2C(CCCc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6726 |
| logD: | 2.6725 |
| logSw: | -3.0869 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.007 |
| InChI Key: | DQXHPYGRXQDLNU-UHFFFAOYSA-N |