(4-{2-chloro-4-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone
Chemical Structure Depiction of
(4-{2-chloro-4-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone
(4-{2-chloro-4-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | C301-7883 |
| Compound Name: | (4-{2-chloro-4-[(5-methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone |
| Molecular Weight: | 530.05 |
| Molecular Formula: | C27 H24 Cl N7 O S |
| Smiles: | Cc1cc(Nc2ccc(c(c2)[Cl])N2CCN(CC2)C(c2cccs2)=O)n2c(n1)nc(c1ccccc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.7364 |
| logD: | 5.7218 |
| logSw: | -5.8934 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.466 |
| InChI Key: | YXANITWCEUAEEF-UHFFFAOYSA-N |