ethyl 1-{1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
ethyl 1-{1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | G015-0672 |
| Compound Name: | ethyl 1-{1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C21 H30 N6 O3 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2C(N2CCC(CC2)C(=O)OCC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.5224 |
| logD: | 1.6653 |
| logSw: | -2.3955 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.812 |
| InChI Key: | CWCGEDCHXITEIJ-UHFFFAOYSA-N |