3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
Compound characteristics
| Compound ID: | F797-0608 |
| Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C27 H33 N5 O4 |
| Smiles: | CCN(CCCNC(CCN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.4658 |
| logD: | 2.4335 |
| logSw: | -2.7705 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.839 |
| InChI Key: | ZABUAECOGPIFJS-UHFFFAOYSA-N |