N-{3-[(2H-1,3-benzodioxol-5-yl)(4-ethylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[(2H-1,3-benzodioxol-5-yl)(4-ethylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl}thiophene-2-carboxamide
N-{3-[(2H-1,3-benzodioxol-5-yl)(4-ethylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | D411-0737 |
| Compound Name: | N-{3-[(2H-1,3-benzodioxol-5-yl)(4-ethylpiperazin-1-yl)methyl]-4,5-dimethylthiophen-2-yl}thiophene-2-carboxamide |
| Molecular Weight: | 483.65 |
| Molecular Formula: | C25 H29 N3 O3 S2 |
| Smiles: | CCN1CCN(CC1)C(c1ccc2c(c1)OCO2)c1c(C)c(C)sc1NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0289 |
| logD: | 4.2077 |
| logSw: | -4.6323 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.548 |
| InChI Key: | RETIIUQYYBQSAC-HSZRJFAPSA-N |