7-methyl-4-[(4-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-4-[(4-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-2H-1-benzopyran-2-one
7-methyl-4-[(4-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0997 |
| Compound Name: | 7-methyl-4-[(4-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}piperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1cccc(c1)c1nc(CN2CCN(CC2)CC2=CC(=O)Oc3cc(C)ccc23)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9857 |
| logD: | 3.9633 |
| logSw: | -4.1022 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.041 |
| InChI Key: | YWKFKMGYHYONAI-UHFFFAOYSA-N |