N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide
N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V024-7725 |
| Compound Name: | N-tert-butyl-4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C26 H35 N7 O2 |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(C3CC3)nc2n(c2ccc(cc2)OC)n1)N1CCCN(CC1)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6994 |
| logD: | 3.0624 |
| logSw: | -4.5493 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.796 |
| InChI Key: | XYIFXGFAXLIAIE-UHFFFAOYSA-N |