1-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
1-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | Y020-7757 |
Compound Name: | 1-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide |
Molecular Weight: | 407.92 |
Molecular Formula: | C18 H22 Cl N5 O2 S |
Smiles: | CCn1c(c2ccc(cc2)[Cl])nnc1SCC(N1CCC(CC1)C(N)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0666 |
logD: | 2.0666 |
logSw: | -2.778 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.417 |
InChI Key: | VBPINQBRTHQQAA-UHFFFAOYSA-N |