5-[(4-bromophenyl)methyl]-3-[(2-chlorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(4-bromophenyl)methyl]-3-[(2-chlorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(4-bromophenyl)methyl]-3-[(2-chlorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0756 |
| Compound Name: | 5-[(4-bromophenyl)methyl]-3-[(2-chlorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 492.8 |
| Molecular Formula: | C25 H19 Br Cl N3 O |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3ccccc3[Cl])C=N1)=O)n2Cc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5918 |
| logD: | 6.5918 |
| logSw: | -6.1155 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | OEXIJWDRCUCGMY-UHFFFAOYSA-N |