2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(2,4,6-trimethylphenyl)acetamide
2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | J079-1076 |
| Compound Name: | 2-{4-[(7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)CC(Nc3c(C)cc(C)cc3C)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7094 |
| logD: | 3.672 |
| logSw: | -3.8028 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.673 |
| InChI Key: | MQZXKDUSIUTBDM-UHFFFAOYSA-N |