N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-2-(thiophen-2-yl)acetamide
Chemical Structure Depiction of
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-2-(thiophen-2-yl)acetamide
N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-2-(thiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | V011-0470 |
| Compound Name: | N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methylbutyl)-2-(thiophen-2-yl)acetamide |
| Molecular Weight: | 497.68 |
| Molecular Formula: | C27 H36 F N5 O S |
| Salt: | not_available |
| Smiles: | CC(C)CCN(Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(C)CC1)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8243 |
| logD: | 2.9079 |
| logSw: | -4.6218 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.072 |
| InChI Key: | CSOIEVJVDJAIBP-UHFFFAOYSA-N |