2-tert-butyl-4-(3-chloro-4-fluorophenyl)-N~6~-(2-methoxyethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Chemical Structure Depiction of
2-tert-butyl-4-(3-chloro-4-fluorophenyl)-N~6~-(2-methoxyethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
2-tert-butyl-4-(3-chloro-4-fluorophenyl)-N~6~-(2-methoxyethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Compound characteristics
| Compound ID: | V001-3051 |
| Compound Name: | 2-tert-butyl-4-(3-chloro-4-fluorophenyl)-N~6~-(2-methoxyethyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine |
| Molecular Weight: | 392.86 |
| Molecular Formula: | C18 H22 Cl F N6 O |
| Salt: | not_available |
| Smiles: | CC(C)(C)n1c(c2c(c3ccc(c(c3)[Cl])F)nc(NCCOC)nc2n1)N |
| Stereo: | ACHIRAL |
| logP: | 3.5668 |
| logD: | 3.562 |
| logSw: | -4.0592 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.233 |
| InChI Key: | QQUYOQOFNIRKIL-UHFFFAOYSA-N |