1-[4-(1-methyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(naphthalene-2-sulfonyl)propan-1-one
Chemical Structure Depiction of
1-[4-(1-methyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(naphthalene-2-sulfonyl)propan-1-one
1-[4-(1-methyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(naphthalene-2-sulfonyl)propan-1-one
Compound characteristics
| Compound ID: | Y503-1091 |
| Compound Name: | 1-[4-(1-methyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(naphthalene-2-sulfonyl)propan-1-one |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C21 H24 N4 O5 S2 |
| Smiles: | Cn1cc(cn1)S(N1CCN(CC1)C(CCS(c1ccc2ccccc2c1)(=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5916 |
| logD: | 0.5916 |
| logSw: | -2.4448 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.452 |
| InChI Key: | HDPFJIQONUEQQR-UHFFFAOYSA-N |