3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methoxyphenyl)propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methoxyphenyl)propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | F797-0452 |
| Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methoxyphenyl)propanamide |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C22 H22 N4 O5 |
| Smiles: | COc1ccc(cc1)NC(CCN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.758 |
| logD: | 1.758 |
| logSw: | -2.398 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.229 |
| InChI Key: | JLEYXVIYMJPJRR-UHFFFAOYSA-N |