1-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propan-1-one
Chemical Structure Depiction of
1-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propan-1-one
1-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propan-1-one
Compound characteristics
| Compound ID: | S517-1436 |
| Compound Name: | 1-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-3-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)propan-1-one |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C25 H33 N5 O |
| Smiles: | CCn1cnnc1CC1CCN(CC1)C(CCn1c2CCCCc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3436 |
| logD: | 3.3396 |
| logSw: | -3.4525 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.772 |
| InChI Key: | JTHDTUIFFHZKEO-UHFFFAOYSA-N |