1-benzyl-4-(5-{2-[(4-cyclohexylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperazine
Chemical Structure Depiction of
1-benzyl-4-(5-{2-[(4-cyclohexylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperazine
1-benzyl-4-(5-{2-[(4-cyclohexylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperazine
Compound characteristics
| Compound ID: | E958-0643 |
| Compound Name: | 1-benzyl-4-(5-{2-[(4-cyclohexylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperazine |
| Molecular Weight: | 505.73 |
| Molecular Formula: | C28 H39 N7 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)Cc1cccn1c1nnc(N2CCN(CC2)Cc2ccccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.4363 |
| logD: | 3.4546 |
| logSw: | -4.2054 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.721 |
| InChI Key: | NSJHAEPNCTZXIG-UHFFFAOYSA-N |