5-(cyclohexylamino)-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-(cyclohexylamino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(cyclohexylamino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0277 |
| Compound Name: | 5-(cyclohexylamino)-3-{4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 582.7 |
| Molecular Formula: | C34 H38 N4 O5 |
| Smiles: | COc1ccc(CN2CCN(CC2)c2cc(c3C(c4ccccc4c4c3c2no4)=O)NC2CCCCC2)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 6.8052 |
| logD: | 6.3416 |
| logSw: | -5.9424 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.199 |
| InChI Key: | MGKSVDYEJFAKRS-UHFFFAOYSA-N |