N-[3-(4-methylpiperazin-1-yl)propyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Chemical Structure Depiction of
N-[3-(4-methylpiperazin-1-yl)propyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
N-[3-(4-methylpiperazin-1-yl)propyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea
Compound characteristics
| Compound ID: | E942-0094 |
| Compound Name: | N-[3-(4-methylpiperazin-1-yl)propyl]-N'-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]urea |
| Molecular Weight: | 399.54 |
| Molecular Formula: | C22 H33 N5 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(NCCCN1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5232 |
| logD: | 0.5225 |
| logSw: | -2.2558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.361 |
| InChI Key: | RLICCTQPDRQZDP-UHFFFAOYSA-N |