N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(dipropylsulfamoyl)benzamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(dipropylsulfamoyl)benzamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(dipropylsulfamoyl)benzamide
Compound characteristics
| Compound ID: | 1000-0406 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(dipropylsulfamoyl)benzamide |
| Molecular Weight: | 445.6 |
| Molecular Formula: | C22 H27 N3 O3 S2 |
| Smiles: | CCCN(CCC)S(c1ccc(cc1)C(Nc1c(C#N)c2CCCCc2s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7588 |
| logD: | 1.648 |
| logSw: | -4.5186 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.705 |
| InChI Key: | RHGFQBHCQIITIM-UHFFFAOYSA-N |