2-(diethylamino)ethyl 4-{[3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-{[3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}benzoate
2-(diethylamino)ethyl 4-{[3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C498-0931 |
| Compound Name: | 2-(diethylamino)ethyl 4-{[3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}benzoate |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C26 H27 F N4 O3 S |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(c1cc2c(c3ccccc3F)nn(C)c2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2025 |
| logD: | 4.2341 |
| logSw: | -5.0819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.907 |
| InChI Key: | YJQGAXPXZHAUSY-UHFFFAOYSA-N |