1-{4-[6-(2-methylpropyl)-3-(3-phenoxyphenyl)[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one
Chemical Structure Depiction of
1-{4-[6-(2-methylpropyl)-3-(3-phenoxyphenyl)[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one
1-{4-[6-(2-methylpropyl)-3-(3-phenoxyphenyl)[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one
Compound characteristics
| Compound ID: | V005-1867 |
| Compound Name: | 1-{4-[6-(2-methylpropyl)-3-(3-phenoxyphenyl)[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one |
| Molecular Weight: | 527.67 |
| Molecular Formula: | C31 H37 N5 O3 |
| Salt: | not_available |
| Smiles: | CCCCC(N1CCCN(CC1)c1c2c(c3cccc(c3)Oc3ccccc3)noc2nc(CC(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1328 |
| logD: | 7.1322 |
| logSw: | -5.9699 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.565 |
| InChI Key: | DTDMYADCJSZLRJ-UHFFFAOYSA-N |