{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(cyclopropyl)methanone
Chemical Structure Depiction of
{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(cyclopropyl)methanone
{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(cyclopropyl)methanone
Compound characteristics
| Compound ID: | V021-7407 |
| Compound Name: | {4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(cyclopropyl)methanone |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C28 H35 F N6 O |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(CC3CCCCC3)nc2n(c2ccc(cc2)F)n1)N1CCCN(CC1)C(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7648 |
| logD: | 5.0743 |
| logSw: | -5.7323 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.196 |
| InChI Key: | UTBWDBVFNMTASK-UHFFFAOYSA-N |