N-(2-phenylethyl)-N'-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]urea
Chemical Structure Depiction of
N-(2-phenylethyl)-N'-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]urea
N-(2-phenylethyl)-N'-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]urea
Compound characteristics
| Compound ID: | S346-0807 |
| Compound Name: | N-(2-phenylethyl)-N'-[3-(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]urea |
| Molecular Weight: | 361.45 |
| Molecular Formula: | C21 H23 N5 O |
| Smiles: | C1CCn2c(C1)nnc2c1cccc(c1)NC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2132 |
| logD: | 3.2106 |
| logSw: | -3.377 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.398 |
| InChI Key: | ZPAROHBJZYPXDA-UHFFFAOYSA-N |