(5-methyl-1,2-benzothiazol-3-yl)[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(5-methyl-1,2-benzothiazol-3-yl)[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]methanone
(5-methyl-1,2-benzothiazol-3-yl)[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | F557-0163 |
| Compound Name: | (5-methyl-1,2-benzothiazol-3-yl)[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]methanone |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | Cc1ccc2c(c1)c(C(N1CCN(CC1)S(c1c(C)cc(C)cc1C)(=O)=O)=O)ns2 |
| Stereo: | ACHIRAL |
| logP: | 4.6996 |
| logD: | 4.6996 |
| logSw: | -4.3805 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.396 |
| InChI Key: | BRSBIJUBWGQIDW-UHFFFAOYSA-N |