3-chloro-N-{3-[1-(cyclopropylamino)-1-oxobutan-2-yl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
Chemical Structure Depiction of
3-chloro-N-{3-[1-(cyclopropylamino)-1-oxobutan-2-yl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
3-chloro-N-{3-[1-(cyclopropylamino)-1-oxobutan-2-yl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
Compound characteristics
| Compound ID: | V007-3198 |
| Compound Name: | 3-chloro-N-{3-[1-(cyclopropylamino)-1-oxobutan-2-yl]-1,3-benzothiazol-2(3H)-ylidene}benzamide |
| Molecular Weight: | 413.92 |
| Molecular Formula: | C21 H20 Cl N3 O2 S |
| Smiles: | CCC(C(NC1CC1)=O)N1/C(=N/C(c2cccc(c2)[Cl])=O)Sc2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1785 |
| logD: | 4.1785 |
| logSw: | -4.3985 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.925 |
| InChI Key: | KXZPIWBDLUMWIE-INIZCTEOSA-N |