5-[(2-chloro-6-fluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(2-chloro-6-fluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0650 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 445.92 |
| Molecular Formula: | C26 H21 Cl F N3 O |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(CCc3ccccc3)C=N1)=O)n2Cc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 6.0215 |
| logD: | 6.0215 |
| logSw: | -6.03 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9068 |
| InChI Key: | JHQGNMVHXYRBFS-UHFFFAOYSA-N |