methyl 4-({1-[6-(thiophen-2-yl)pyridazin-3-yl]piperidine-4-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({1-[6-(thiophen-2-yl)pyridazin-3-yl]piperidine-4-carbonyl}amino)benzoate
methyl 4-({1-[6-(thiophen-2-yl)pyridazin-3-yl]piperidine-4-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | G274-0245 |
| Compound Name: | methyl 4-({1-[6-(thiophen-2-yl)pyridazin-3-yl]piperidine-4-carbonyl}amino)benzoate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(C1CCN(CC1)c1ccc(c2cccs2)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7002 |
| logD: | 3.6997 |
| logSw: | -3.8783 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.909 |
| InChI Key: | CASWHANLGBCDRV-UHFFFAOYSA-N |