N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Compound characteristics
| Compound ID: | T408-0481 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C22 H24 N2 O5 S |
| Smiles: | C1Cc2c(CC1C(NCc1ccc3c(c1)OCO3)=O)cc(C(N1CCOCC1)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4555 |
| logD: | 2.4555 |
| logSw: | -2.9611 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.263 |
| InChI Key: | SSBNUVLMPZLGPL-OAHLLOKOSA-N |