6-benzyl-4-[4-(methanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-4-[4-(methanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-4-[4-(methanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V020-4433 |
| Compound Name: | 6-benzyl-4-[4-(methanesulfonyl)-1,4-diazepan-1-yl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C25 H28 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(Cc3ccccc3)nc2n(c2ccccc2)n1)N1CCCN(CC1)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8484 |
| logD: | 3.7466 |
| logSw: | -4.1781 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.308 |
| InChI Key: | REGJYQQALDZRKA-UHFFFAOYSA-N |