5-[(3,5-difluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(3,5-difluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(3,5-difluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | C200-8551 |
| Compound Name: | 5-[(3,5-difluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C26 H21 F2 N3 O |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(CCc3ccccc3)C=N1)=O)n2Cc1cc(cc(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 5.8212 |
| logD: | 5.8212 |
| logSw: | -5.619 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9068 |
| InChI Key: | VGCNIXOLHJWJKT-UHFFFAOYSA-N |