1-{4-[4-(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
1-{4-[4-(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)piperazin-1-yl]phenyl}ethan-1-one
Compound characteristics
Compound ID: | E475-0484 |
Compound Name: | 1-{4-[4-(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)piperazin-1-yl]phenyl}ethan-1-one |
Molecular Weight: | 417.46 |
Molecular Formula: | C24 H23 N3 O4 |
Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1c2COc3ccc(C)cc3c2on1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2426 |
logD: | 3.2426 |
logSw: | -3.3029 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 64.504 |
InChI Key: | IDFJOPDKGCXBAJ-UHFFFAOYSA-N |