N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-1-[(4-methoxyphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-1-[(4-methoxyphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-1-[(4-methoxyphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | IB08-4125 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-imino-1-[(4-methoxyphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 539.59 |
| Molecular Formula: | C30 H29 N5 O5 |
| Smiles: | COc1ccc(CN2C3=C(C=C(C2=N)C(NCCc2ccc(c(c2)OC)OC)=O)C(N2C=CC=CC2=N3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.19 |
| logD: | 1.6 |
| logSw: | -3.43 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 152.5 |
| InChI Key: | JKWFIZWSTBJNMY-UHFFFAOYSA-N |