N-[(4-bromophenyl)methyl]-4-(3,4-dimethyl-1H-pyrazol-5-yl)-2,5-dimethylthiophene-3-sulfonamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-4-(3,4-dimethyl-1H-pyrazol-5-yl)-2,5-dimethylthiophene-3-sulfonamide
N-[(4-bromophenyl)methyl]-4-(3,4-dimethyl-1H-pyrazol-5-yl)-2,5-dimethylthiophene-3-sulfonamide
Compound characteristics
| Compound ID: | M332-0613 |
| Compound Name: | N-[(4-bromophenyl)methyl]-4-(3,4-dimethyl-1H-pyrazol-5-yl)-2,5-dimethylthiophene-3-sulfonamide |
| Molecular Weight: | 454.41 |
| Molecular Formula: | C18 H20 Br N3 O2 S2 |
| Smiles: | Cc1c(C)n[nH]c1c1c(c(C)sc1C)S(NCc1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5047 |
| logD: | 4.502 |
| logSw: | -4.4495 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.852 |
| InChI Key: | YQMRVNFXRFWFMI-UHFFFAOYSA-N |