1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}piperidine-4-carboxamide
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C361-2549 |
| Compound Name: | 1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}piperidine-4-carboxamide |
| Molecular Weight: | 501.67 |
| Molecular Formula: | C24 H31 N5 O3 S2 |
| Smiles: | CCN(CCCNC(C1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7433 |
| logD: | 3.711 |
| logSw: | -3.7058 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.147 |
| InChI Key: | BXBDBXOLSKCLLA-UHFFFAOYSA-N |