2-{[(4-chlorophenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[(4-chlorophenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0062 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]amino}-5-[(pyrrolidin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 358.83 |
| Molecular Formula: | C17 H19 Cl N6 O |
| Smiles: | C1CCN(C1)CC1=CC(n2c(N1)nc(NCc1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0204 |
| logD: | 2.0204 |
| logSw: | -2.9494 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.079 |
| InChI Key: | DZMJXQJCDDBJRC-UHFFFAOYSA-N |