2-(azepane-1-carbonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
2-(azepane-1-carbonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Compound characteristics
| Compound ID: | T408-1232 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide |
| Molecular Weight: | 446.66 |
| Molecular Formula: | C24 H38 N4 O2 S |
| Smiles: | CN1CCN(CCCNC(C2CCc3c(C2)cc(C(N2CCCCCC2)=O)s3)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5458 |
| logD: | 1.3413 |
| logSw: | -2.6747 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.871 |
| InChI Key: | FPBKHTWNHYFUBP-LJQANCHMSA-N |