4-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
4-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidine
4-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V021-3353 |
| Compound Name: | 4-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C22 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)S(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6766 |
| logD: | 3.2328 |
| logSw: | -4.0041 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.981 |
| InChI Key: | GGBMKWMWPDCSKX-UHFFFAOYSA-N |