3-{3-[butyl(methyl)amino]propyl}-8-chloro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-{3-[butyl(methyl)amino]propyl}-8-chloro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{3-[butyl(methyl)amino]propyl}-8-chloro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0378 |
| Compound Name: | 3-{3-[butyl(methyl)amino]propyl}-8-chloro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 346.86 |
| Molecular Formula: | C18 H23 Cl N4 O |
| Smiles: | CCCCN(C)CCCN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9292 |
| logD: | 0.8893 |
| logSw: | -3.5543 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.62 |
| InChI Key: | LUVLMUBKZNRDHZ-UHFFFAOYSA-N |