N-(3-bromophenyl)-1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
N-(3-bromophenyl)-1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | E201-0319 |
Compound Name: | N-(3-bromophenyl)-1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide |
Molecular Weight: | 411.26 |
Molecular Formula: | C19 H15 Br N4 O2 |
Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(Nc3cccc(c3)[Br])=O)n1C)C2=O |
Stereo: | ACHIRAL |
logP: | 3.5393 |
logD: | 3.5032 |
logSw: | -3.7594 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.514 |
InChI Key: | NTHNATUYCPUOFD-UHFFFAOYSA-N |