2'-(cyclopropylmethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
Chemical Structure Depiction of
2'-(cyclopropylmethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
2'-(cyclopropylmethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one
Compound characteristics
| Compound ID: | S560-0049 |
| Compound Name: | 2'-(cyclopropylmethyl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepin]-3'(2'H)-one |
| Molecular Weight: | 276.38 |
| Molecular Formula: | C15 H24 N4 O |
| Smiles: | C1CC2(CCNCC2)CCN2C1=NN(CC1CC1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 0.9292 |
| logD: | -1.0985 |
| logSw: | -1.2147 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.92 |
| InChI Key: | RPZMUKSCHBENMD-UHFFFAOYSA-N |