1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(2-ethoxyphenyl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(2-ethoxyphenyl)methyl]piperidine-3-carboxamide
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(2-ethoxyphenyl)methyl]piperidine-3-carboxamide
Compound characteristics
Compound ID: | C857-2248 |
Compound Name: | 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(2-ethoxyphenyl)methyl]piperidine-3-carboxamide |
Molecular Weight: | 439.58 |
Molecular Formula: | C23 H29 N5 O2 S |
Smiles: | CCOc1ccccc1CNC(C1CCCN(C1)c1nnc(n2c(C)ccc2C)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6411 |
logD: | 3.641 |
logSw: | -3.6449 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.271 |
InChI Key: | DDQHRKGKAIQLDG-IBGZPJMESA-N |