3-[(1-benzylpiperidin-4-yl)amino]-5-(3-bromophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-[(1-benzylpiperidin-4-yl)amino]-5-(3-bromophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
3-[(1-benzylpiperidin-4-yl)amino]-5-(3-bromophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
Compound ID: | E013-1978 |
Compound Name: | 3-[(1-benzylpiperidin-4-yl)amino]-5-(3-bromophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
Molecular Weight: | 474.42 |
Molecular Formula: | C22 H24 Br N3 O2 S |
Smiles: | CC1=C(c2cccc(c2)[Br])S(N=C1NC1CCN(CC1)Cc1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1689 |
logD: | 3.2384 |
logSw: | -4.1564 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.432 |
InChI Key: | WBCYAPUALFEQFB-UHFFFAOYSA-N |