5-(4-fluoroanilino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(4-fluoroanilino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(4-fluoroanilino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0364 |
| Compound Name: | 5-(4-fluoroanilino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 594.64 |
| Molecular Formula: | C34 H31 F N4 O5 |
| Smiles: | COc1ccc(CN2CCN(CC2)c2cc(c3C(c4ccccc4c4c3c2no4)=O)Nc2ccc(cc2)F)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 6.9967 |
| logD: | 6.5331 |
| logSw: | -6.053 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.152 |
| InChI Key: | NFNPZSSWZITWRB-UHFFFAOYSA-N |