1-(4-{4-[5-(3,4-dimethyl-1H-pyrazol-5-yl)furan-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[5-(3,4-dimethyl-1H-pyrazol-5-yl)furan-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[5-(3,4-dimethyl-1H-pyrazol-5-yl)furan-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F825-0902 |
| Compound Name: | 1-(4-{4-[5-(3,4-dimethyl-1H-pyrazol-5-yl)furan-2-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1ccc(c2c(C)c(C)n[nH]2)o1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7657 |
| logD: | 2.7651 |
| logSw: | -3.2264 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.765 |
| InChI Key: | AIYSGKZVIDNGCF-UHFFFAOYSA-N |