N-{3-[(4-phenylpiperazin-1-yl)(pyridin-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{3-[(4-phenylpiperazin-1-yl)(pyridin-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
N-{3-[(4-phenylpiperazin-1-yl)(pyridin-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D411-0941 |
| Compound Name: | N-{3-[(4-phenylpiperazin-1-yl)(pyridin-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide |
| Molecular Weight: | 498.65 |
| Molecular Formula: | C29 H30 N4 O2 S |
| Smiles: | C1CCc2c(C1)c(C(c1ccccn1)N1CCN(CC1)c1ccccc1)c(NC(c1ccco1)=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1216 |
| logD: | 4.8514 |
| logSw: | -5.1881 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.685 |
| InChI Key: | ADSMMCJFCKSFRR-HHHXNRCGSA-N |