N-cyclopropyl-2-{[6-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-cyclopropyl-2-{[6-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
N-cyclopropyl-2-{[6-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 8009-3903 |
Compound Name: | N-cyclopropyl-2-{[6-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide |
Molecular Weight: | 459.54 |
Molecular Formula: | C24 H17 N3 O3 S2 |
Smiles: | C1CC1NC(CSc1nc2ccc(cc2s1)N1C(c2cccc3cccc(C1=O)c23)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7718 |
logD: | 3.7718 |
logSw: | -4.2406 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.58 |
InChI Key: | ACFGUXNSOXDZMG-UHFFFAOYSA-N |