N-tert-butyl-4-(3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-(3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide
N-tert-butyl-4-(3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
Compound ID: | V019-4687 |
Compound Name: | N-tert-butyl-4-(3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxamide |
Molecular Weight: | 449.6 |
Molecular Formula: | C25 H35 N7 O |
Salt: | not_available |
Smiles: | CCCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)C(NC(C)(C)C)=O |
Stereo: | ACHIRAL |
logP: | 4.8399 |
logD: | 4.3961 |
logSw: | -4.6901 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.991 |
InChI Key: | AVFIZKANNHULLR-UHFFFAOYSA-N |