{4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
{4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
Compound characteristics
Compound ID: | V011-0406 |
Compound Name: | {4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone |
Molecular Weight: | 478.59 |
Molecular Formula: | C25 H27 F N6 O S |
Salt: | not_available |
Smiles: | CCCc1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCCN(CC1)C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 5.1003 |
logD: | 4.6565 |
logSw: | -5.0208 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 55.771 |
InChI Key: | PGRQLTIOIGDAIN-UHFFFAOYSA-N |