{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
Chemical Structure Depiction of
{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | V027-8001 |
| Compound Name: | {4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(4-methoxyphenyl)methanone |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C29 H32 N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(C3CC3)nc2n(c2ccc(cc2)OC)n1)N1CCCN(CC1)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6552 |
| logD: | 3.0182 |
| logSw: | -4.6053 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.101 |
| InChI Key: | OUFOTUQPARBSGK-UHFFFAOYSA-N |