methyl 4-({3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carbonyl}amino)benzoate
methyl 4-({3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | T501-0241 |
| Compound Name: | methyl 4-({3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 371.44 |
| Molecular Formula: | C19 H25 N5 O3 |
| Smiles: | CCn1cnnc1CC1CCCN(C1)C(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1169 |
| logD: | 2.1168 |
| logSw: | -2.8032 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.872 |
| InChI Key: | QGWKVWYQUOFVMG-CQSZACIVSA-N |