N-(4-ethoxyphenyl)-3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]-1-carboxamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]-1-carboxamide
N-(4-ethoxyphenyl)-3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]-1-carboxamide
Compound characteristics
| Compound ID: | S895-1053 |
| Compound Name: | N-(4-ethoxyphenyl)-3'-(2-methoxyethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]-1-carboxamide |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C23 H33 N5 O3 |
| Smiles: | CCOc1ccc(cc1)NC(N1CCC2(CCc3nnc(CCOC)n3CC2)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9215 |
| logD: | 1.9211 |
| logSw: | -2.4649 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.174 |
| InChI Key: | UFAUZFRCAHEYOI-UHFFFAOYSA-N |