2-methyl-N-[2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]propanamide
Chemical Structure Depiction of
2-methyl-N-[2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]propanamide
2-methyl-N-[2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]propanamide
Compound characteristics
Compound ID: | D336-3422 |
Compound Name: | 2-methyl-N-[2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]propanamide |
Molecular Weight: | 392.52 |
Molecular Formula: | C16 H16 N4 O2 S3 |
Smiles: | CC(C)C(Nc1ccc2c(c1)sc(n2)SCC(Nc1nccs1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6457 |
logD: | 3.6453 |
logSw: | -3.83 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.039 |
InChI Key: | MJKSHTJGJKPLOH-UHFFFAOYSA-N |