1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide
1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | M042-0116 |
Compound Name: | 1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide |
Molecular Weight: | 475.63 |
Molecular Formula: | C22 H29 N5 O3 S2 |
Smiles: | CC(Nc1c(C(N2CCCC2)=O)sc(n1)N1CCC(CC1)C(NCCc1cccs1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2862 |
logD: | 2.2816 |
logSw: | -2.7831 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.701 |
InChI Key: | PWJHREGKUFWMBU-UHFFFAOYSA-N |