{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V024-7127 |
| Compound Name: | {4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C26 H28 N6 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)c(nc(C1CC1)n2)N1CCCN(CC1)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2503 |
| logD: | 3.6133 |
| logSw: | -5.1869 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.032 |
| InChI Key: | VFJGZIATESCZSM-UHFFFAOYSA-N |