3-benzyl-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-benzyl-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-benzyl-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | C200-7100 |
| Compound Name: | 3-benzyl-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 289.33 |
| Molecular Formula: | C18 H15 N3 O |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3ccccc3)C=N1)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 2.8237 |
| logD: | 2.8237 |
| logSw: | -3.2681 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.297 |
| InChI Key: | YFQJVLXSFBOTSM-UHFFFAOYSA-N |