(4RS)-4,7,7-trimethyl-1-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazine-1-carbonyl)-2-oxabicyclo[2.2.1]heptan-3-one
Chemical Structure Depiction of
(4RS)-4,7,7-trimethyl-1-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazine-1-carbonyl)-2-oxabicyclo[2.2.1]heptan-3-one
(4RS)-4,7,7-trimethyl-1-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazine-1-carbonyl)-2-oxabicyclo[2.2.1]heptan-3-one
Compound characteristics
| Compound ID: | V008-6294 |
| Compound Name: | (4RS)-4,7,7-trimethyl-1-(4-{4-[4-(morpholin-4-yl)phenyl]pyrimidin-2-yl}piperazine-1-carbonyl)-2-oxabicyclo[2.2.1]heptan-3-one |
| Molecular Weight: | 505.62 |
| Molecular Formula: | C28 H35 N5 O4 |
| Salt: | not_available |
| Smiles: | CC1(C)C2(CC[C@@]1(C)C(=O)O2)C(N1CCN(CC1)c1nccc(c2ccc(cc2)N2CCOCC2)n1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5538 |
| logD: | 3.5538 |
| logSw: | -3.4927 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.569 |
| InChI Key: | QZEFNEFDCSIRNP-QXPUDEPPSA-N |