ethyl 2-({2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}carbamamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-({2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}carbamamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-({2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}carbamamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | C270-0585 |
| Compound Name: | ethyl 2-({2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}carbamamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C25 H34 N4 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(NCCN1CCN(CC1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0651 |
| logD: | 4.0651 |
| logSw: | -4.1957 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.96 |
| InChI Key: | KFRYPXWGSFHYLR-UHFFFAOYSA-N |