methyl 2-[2-({6-[3-(cyclopropylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-({6-[3-(cyclopropylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
methyl 2-[2-({6-[3-(cyclopropylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | M145-0048 |
| Compound Name: | methyl 2-[2-({6-[3-(cyclopropylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C23 H27 N5 O4 S |
| Smiles: | COC(c1ccccc1NC(CSc1ccc(nn1)N1CCCC(C1)C(NC1CC1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0897 |
| logD: | 2.0732 |
| logSw: | -2.9309 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.015 |
| InChI Key: | IYZKQDMCEORUPM-HNNXBMFYSA-N |