N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-methoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-methoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-methoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | C453-0222 |
| Compound Name: | N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-methoxyphenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide |
| Molecular Weight: | 489.64 |
| Molecular Formula: | C27 H31 N5 O2 S |
| Smiles: | Cn1c2c(cc(C(NCCN3CCN(CC3)Cc3ccccc3)=O)s2)c(c2cccc(c2)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4692 |
| logD: | 3.3306 |
| logSw: | -3.8804 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.678 |
| InChI Key: | QXMVAVLCOVBDHA-UHFFFAOYSA-N |