[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | V024-5519 |
Compound Name: | [4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone |
Molecular Weight: | 446.57 |
Molecular Formula: | C24 H26 N6 O S |
Salt: | not_available |
Smiles: | CCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.3518 |
logD: | 3.9764 |
logSw: | -4.3604 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 55.771 |
InChI Key: | JORPAIWXALIDNJ-UHFFFAOYSA-N |