N-(2-{benzyl[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-bromo-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
N-(2-{benzyl[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-bromo-N-(prop-2-en-1-yl)benzamide
N-(2-{benzyl[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-bromo-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V030-8517 |
| Compound Name: | N-(2-{benzyl[(6-methyl-4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-bromo-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 559.46 |
| Molecular Formula: | C30 H27 Br N2 O4 |
| Smiles: | Cc1ccc2c(c1)C(C(CN(Cc1ccccc1)C(CN(CC=C)C(c1ccc(cc1)[Br])=O)=O)=CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9594 |
| logD: | 4.9594 |
| logSw: | -4.6727 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.005 |
| InChI Key: | GZSIYSLIXWKQOH-UHFFFAOYSA-N |