N-acetyl-N-[4-(benzenesulfonyl)-1-[(4-bromophenyl)methyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]acetamide
Chemical Structure Depiction of
N-acetyl-N-[4-(benzenesulfonyl)-1-[(4-bromophenyl)methyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]acetamide
N-acetyl-N-[4-(benzenesulfonyl)-1-[(4-bromophenyl)methyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]acetamide
Compound characteristics
| Compound ID: | C201-0419 |
| Compound Name: | N-acetyl-N-[4-(benzenesulfonyl)-1-[(4-bromophenyl)methyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]acetamide |
| Molecular Weight: | 522.44 |
| Molecular Formula: | C21 H20 Br N3 O4 S2 |
| Smiles: | CC(N(C(C)=O)c1c(c(nn1Cc1ccc(cc1)[Br])SC)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0773 |
| logD: | 3.0773 |
| logSw: | -3.1997 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.927 |
| InChI Key: | BEINLYRZCXLGQL-UHFFFAOYSA-N |