4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxobutanamide
Chemical Structure Depiction of
4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxobutanamide
4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1126 |
| Compound Name: | 4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]-4-oxobutanamide |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C21 H32 N4 O3 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CCC(NCCCN1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5022 |
| logD: | -0.7024 |
| logSw: | -1.9403 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.747 |
| InChI Key: | VIYRDFPJEUNKAI-UHFFFAOYSA-N |