(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | E475-0370 |
| Compound Name: | (8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 420.42 |
| Molecular Formula: | C22 H20 N4 O5 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)c(C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.6262 |
| logD: | 3.6262 |
| logSw: | -3.8674 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.059 |
| InChI Key: | LKTWNJMGPCCTPL-UHFFFAOYSA-N |