3-[(2-chlorophenyl)methyl]-8-methyl-5-[(3-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-8-methyl-5-[(3-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[(2-chlorophenyl)methyl]-8-methyl-5-[(3-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0743 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-8-methyl-5-[(3-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 427.93 |
| Molecular Formula: | C26 H22 Cl N3 O |
| Smiles: | Cc1cccc(Cn2c3C(N(Cc4ccccc4[Cl])C=Nc3c3cc(C)ccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4045 |
| logD: | 6.4045 |
| logSw: | -6.1372 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | KYPOBEZOTQJDKJ-UHFFFAOYSA-N |