N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3,5-dimethoxyaniline
Chemical Structure Depiction of
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3,5-dimethoxyaniline
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3,5-dimethoxyaniline
Compound characteristics
| Compound ID: | E958-0961 |
| Compound Name: | N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3,5-dimethoxyaniline |
| Molecular Weight: | 482.65 |
| Molecular Formula: | C25 H34 N6 O2 S |
| Smiles: | COc1cc(cc(c1)OC)NCc1cccn1c1nnc(N2CCN(CC2)C2CCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.0244 |
| logD: | 4.204 |
| logSw: | -4.6287 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.77 |
| InChI Key: | QUSMJIIVYJCFQL-UHFFFAOYSA-N |