N-(6-methyl-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-4-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(6-methyl-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-4-(pyrrolidine-1-sulfonyl)benzamide
N-(6-methyl-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-4-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | G856-6886 |
| Compound Name: | N-(6-methyl-1,3-benzothiazol-2-yl)-N-[(pyridin-3-yl)methyl]-4-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C25 H24 N4 O3 S2 |
| Smiles: | Cc1ccc2c(c1)sc(n2)N(Cc1cccnc1)C(c1ccc(cc1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3765 |
| logD: | 4.3763 |
| logSw: | -4.0277 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.72 |
| InChI Key: | JQICULVHJMNMSG-UHFFFAOYSA-N |