N-(2-ethoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(2-ethoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | K801-0381 |
| Compound Name: | N-(2-ethoxyphenyl)-2-{[(pyridin-2-yl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C23 H25 N3 O2 S |
| Smiles: | CCOc1ccccc1NC(c1c2CCCCc2sc1NCc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7253 |
| logD: | 4.7251 |
| logSw: | -4.5069 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.335 |
| InChI Key: | XASZJTVNABIHPU-UHFFFAOYSA-N |