1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-4-carboxamide
1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M042-0012 |
| Compound Name: | 1-[4-acetamido-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C24 H29 N5 O5 S |
| Smiles: | CC(Nc1c(C(N2CCCC2)=O)sc(n1)N1CCC(CC1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0667 |
| logD: | 2.0621 |
| logSw: | -2.8918 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.956 |
| InChI Key: | HECKUSOEVRCCDP-UHFFFAOYSA-N |