1-[(2-chlorophenyl)methyl]-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
1-[(2-chlorophenyl)methyl]-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0232 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-3'-(methoxymethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 374.91 |
| Molecular Formula: | C20 H27 Cl N4 O |
| Smiles: | COCc1nnc2CCC3(CCN(CC3)Cc3ccccc3[Cl])CCn12 |
| Stereo: | ACHIRAL |
| logP: | 2.3769 |
| logD: | 2.2041 |
| logSw: | -2.9406 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.395 |
| InChI Key: | RNXAWUTXXIBUPX-UHFFFAOYSA-N |