propan-2-yl 2-({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylate
propan-2-yl 2-({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylate
Compound characteristics
| Compound ID: | K786-1529 |
| Compound Name: | propan-2-yl 2-({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylate |
| Molecular Weight: | 310.41 |
| Molecular Formula: | C15 H22 N2 O3 S |
| Smiles: | CCC(C)NC(CSc1c(cccn1)C(=O)OC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.397 |
| logD: | 2.397 |
| logSw: | -2.8048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.763 |
| InChI Key: | ZTCWJYZHVCSCMU-NSHDSACASA-N |