[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V015-7931 |
| Compound Name: | [4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C28 H26 N6 O S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6462 |
| logD: | 5.6357 |
| logSw: | -5.707 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.147 |
| InChI Key: | MMRFVYVDACBGGP-UHFFFAOYSA-N |