N-(2-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-N'-propylurea
Chemical Structure Depiction of
N-(2-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-N'-propylurea
N-(2-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-N'-propylurea
Compound characteristics
| Compound ID: | V027-6389 |
| Compound Name: | N-(2-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-N'-propylurea |
| Molecular Weight: | 431.92 |
| Molecular Formula: | C20 H26 Cl N7 O2 |
| Salt: | not_available |
| Smiles: | CCCNC(NCCNc1c2c(C)nn(c3cccc(c3)[Cl])c2nc(COC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.484 |
| logD: | 2.3981 |
| logSw: | -3.4386 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.893 |
| InChI Key: | GJSIFSQXMGOGPE-UHFFFAOYSA-N |