3-{4-[4-(methanesulfonyl)piperazin-1-yl]anilino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-{4-[4-(methanesulfonyl)piperazin-1-yl]anilino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-{4-[4-(methanesulfonyl)piperazin-1-yl]anilino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | D257-0739 |
| Compound Name: | 3-{4-[4-(methanesulfonyl)piperazin-1-yl]anilino}-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C18 H20 N4 O4 S2 |
| Smiles: | CS(N1CCN(CC1)c1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5008 |
| logD: | 1.4942 |
| logSw: | -2.3438 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.58 |
| InChI Key: | MFWGSEPBTFSNBG-UHFFFAOYSA-N |