3-methyl-1-{4-[(7-nitro-2-phenylimidazo[2,1-b][1,3]benzothiazol-3-yl)methyl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{4-[(7-nitro-2-phenylimidazo[2,1-b][1,3]benzothiazol-3-yl)methyl]piperazin-1-yl}butan-1-one
3-methyl-1-{4-[(7-nitro-2-phenylimidazo[2,1-b][1,3]benzothiazol-3-yl)methyl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V021-1142 |
| Compound Name: | 3-methyl-1-{4-[(7-nitro-2-phenylimidazo[2,1-b][1,3]benzothiazol-3-yl)methyl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C25 H27 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCN(CC1)Cc1c(c2ccccc2)nc2n1c1ccc(cc1s2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3286 |
| logD: | 4.3199 |
| logSw: | -4.1939 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.067 |
| InChI Key: | BOYSYMNYVKUOOC-UHFFFAOYSA-N |