5-(3-bromophenyl)-3-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
5-(3-bromophenyl)-3-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
5-(3-bromophenyl)-3-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
Compound ID: | E013-2168 |
Compound Name: | 5-(3-bromophenyl)-3-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
Molecular Weight: | 476.39 |
Molecular Formula: | C21 H22 Br N3 O3 S |
Smiles: | CC1=C(c2cccc(c2)[Br])S(N=C1N1CCN(CC1)c1ccc(cc1)OC)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.4642 |
logD: | 4.4632 |
logSw: | -4.3897 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 53.934 |
InChI Key: | DVRLMXKZJZQBOF-UHFFFAOYSA-N |