1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione
Chemical Structure Depiction of
1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione
1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione
Compound characteristics
| Compound ID: | E015-0319 |
| Compound Name: | 1-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione |
| Molecular Weight: | 427.93 |
| Molecular Formula: | C23 H26 Cl N3 O3 |
| Smiles: | CC1CN(C(CCC(N2CCN(CC2)c2ccccc2)=O)=O)c2cc(ccc2O1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3034 |
| logD: | 3.3033 |
| logSw: | -3.6068 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.725 |
| InChI Key: | UDSATRIIJQKRSN-QGZVFWFLSA-N |