N-[(1H-benzimidazol-2-yl)methyl]-4-chloro-3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-4-chloro-3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamide
N-[(1H-benzimidazol-2-yl)methyl]-4-chloro-3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamide
Compound characteristics
Compound ID: | Y041-7609 |
Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-4-chloro-3-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)benzamide |
Molecular Weight: | 418.9 |
Molecular Formula: | C19 H19 Cl N4 O3 S |
Smiles: | C1CCS(N(C1)c1cc(ccc1[Cl])C(NCc1nc2ccccc2[nH]1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4446 |
logD: | 2.4441 |
logSw: | -3.4448 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 76.302 |
InChI Key: | YTPPJIJXKGVECV-UHFFFAOYSA-N |