{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(4-phenylpiperazin-1-yl)methanone
{1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(4-phenylpiperazin-1-yl)methanone
Compound characteristics
Compound ID: | C857-2011 |
Compound Name: | {1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidin-4-yl}(4-phenylpiperazin-1-yl)methanone |
Molecular Weight: | 450.61 |
Molecular Formula: | C24 H30 N6 O S |
Smiles: | Cc1ccc(C)n1c1nnc(N2CCC(CC2)C(N2CCN(CC2)c2ccccc2)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.5975 |
logD: | 3.5974 |
logSw: | -3.4869 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 49.622 |
InChI Key: | ODMGRQQZNSAWID-UHFFFAOYSA-N |