6-chloro-2-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-chloro-2-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
6-chloro-2-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D298-0553 |
| Compound Name: | 6-chloro-2-[({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 377.83 |
| Molecular Formula: | C17 H20 Cl N5 O3 |
| Smiles: | CC(C)Oc1ccc(CNc2nc3NC(C)=C(C(n3n2)=O)[Cl])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5426 |
| logD: | 0.9176 |
| logSw: | -3.4889 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.412 |
| InChI Key: | NGZMFKLLSJWRGW-UHFFFAOYSA-N |