N-(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazine-1-carbothioyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazine-1-carbothioyl)thiophene-2-carboxamide
N-(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazine-1-carbothioyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 4244-1560 |
| Compound Name: | N-(4-{4-nitro-3-[(1-phenylethyl)amino]phenyl}piperazine-1-carbothioyl)thiophene-2-carboxamide |
| Molecular Weight: | 495.62 |
| Molecular Formula: | C24 H25 N5 O3 S2 |
| Smiles: | CC(c1ccccc1)Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)C(NC(c1cccs1)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7311 |
| logD: | 4.7311 |
| logSw: | -4.4949 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.375 |
| InChI Key: | PFHAHRYLDPWQEK-KRWDZBQOSA-N |