N-(3-methylbutyl)-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
N-(3-methylbutyl)-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Compound characteristics
| Compound ID: | T408-2018 |
| Compound Name: | N-(3-methylbutyl)-2-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide |
| Molecular Weight: | 348.51 |
| Molecular Formula: | C19 H28 N2 O2 S |
| Smiles: | CC(C)CCNC(C1CCc2c(C1)cc(C(N1CCCC1)=O)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6803 |
| logD: | 3.6803 |
| logSw: | -3.8162 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.718 |
| InChI Key: | PTXQTTXCTAYQJI-CQSZACIVSA-N |