N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 8013-1023 |
| Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CC1CCc2c(C#N)c(NC(c3cccc(c3)S(N3CCCCC3)(=O)=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2891 |
| logD: | 1.0259 |
| logSw: | -4.3557 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.812 |
| InChI Key: | KEBQSBBHQQVYRG-OAHLLOKOSA-N |