3-[4-(cyclopentylacetyl)-1,4-diazepan-1-yl]-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-[4-(cyclopentylacetyl)-1,4-diazepan-1-yl]-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
3-[4-(cyclopentylacetyl)-1,4-diazepan-1-yl]-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
Compound ID: | P533-0125 |
Compound Name: | 3-[4-(cyclopentylacetyl)-1,4-diazepan-1-yl]-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione |
Molecular Weight: | 415.55 |
Molecular Formula: | C22 H29 N3 O3 S |
Smiles: | CC1=C(c2ccccc2)S(N=C1N1CCCN(CC1)C(CC1CCCC1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.243 |
logD: | 3.243 |
logSw: | -3.4589 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.948 |
InChI Key: | GZURFJMDWKPIAF-UHFFFAOYSA-N |