4-[(4-{[2-(4-methoxyphenyl)-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-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one
4-[(4-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0992 |
| Compound Name: | 4-[(4-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C27 H29 N3 O4 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)Cc3c(C)oc(c4ccc(cc4)OC)n3)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6772 |
| logD: | 3.6549 |
| logSw: | -3.8815 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.585 |
| InChI Key: | QYOYJPYRTKSSPY-UHFFFAOYSA-N |