tert-butyl 4-[(3-ethylphenyl)carbamothioyl]piperazine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[(3-ethylphenyl)carbamothioyl]piperazine-1-carboxylate
tert-butyl 4-[(3-ethylphenyl)carbamothioyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | P160-0050 |
| Compound Name: | tert-butyl 4-[(3-ethylphenyl)carbamothioyl]piperazine-1-carboxylate |
| Molecular Weight: | 349.49 |
| Molecular Formula: | C18 H27 N3 O2 S |
| Smiles: | CCc1cccc(c1)NC(N1CCN(CC1)C(=O)OC(C)(C)C)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6509 |
| logD: | 4.6509 |
| logSw: | -4.4411 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.026 |
| InChI Key: | YYCVKBNAFKATDB-UHFFFAOYSA-N |