4-[(4-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-[(4-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one
4-[(4-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-1034 |
| Compound Name: | 4-[(4-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C28 H31 N3 O5 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)Cc3c(C)oc(c4ccc(c(c4)OC)OC)n3)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2388 |
| logD: | 3.2165 |
| logSw: | -3.4172 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.302 |
| InChI Key: | LNZNVIZOYGIGPF-UHFFFAOYSA-N |