N-(2,4-dimethoxyphenyl)-2-{[(3-methoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-{[(3-methoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-(2,4-dimethoxyphenyl)-2-{[(3-methoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | K801-0308 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-{[(3-methoxyphenyl)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C25 H28 N2 O4 S |
| Smiles: | COc1cccc(CNc2c(C(Nc3ccc(cc3OC)OC)=O)c3CCCCc3s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.303 |
| logD: | 5.3027 |
| logSw: | -5.3374 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.299 |
| InChI Key: | XNZNLZVRLXBTCR-UHFFFAOYSA-N |