1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L306-0641 |
| Compound Name: | 1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 495.66 |
| Molecular Formula: | C22 H33 N5 O4 S2 |
| Smiles: | CN1CCN(CCCNC(C2CCN(CC2)S(c2ccc3c(c2)SC(N3C)=O)(=O)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.1713 |
| logD: | -0.0332 |
| logSw: | -2.4857 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.273 |
| InChI Key: | NCMMDPKGJVLKOI-UHFFFAOYSA-N |