N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3-fluoroaniline
Chemical Structure Depiction of
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3-fluoroaniline
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3-fluoroaniline
Compound characteristics
| Compound ID: | E958-0963 |
| Compound Name: | N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-3-fluoroaniline |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C23 H29 F N6 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)c1nnc(n2cccc2CNc2cccc(c2)F)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.027 |
| logD: | 4.2065 |
| logSw: | -4.8678 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.682 |
| InChI Key: | AAHWVDPOIGWFLE-UHFFFAOYSA-N |