N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[1-{2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[1-{2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[1-{2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C260-1344 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[1-{2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide |
| Molecular Weight: | 596.64 |
| Molecular Formula: | C32 H32 N6 O6 |
| Smiles: | Cc1cc(NC(CN2C(N(Cc3ccc(cc3)C(NCCc3ccc(c(c3)OC)OC)=O)C(c3ccccc23)=O)=O)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.6399 |
| logD: | 2.6371 |
| logSw: | -3.323 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 117.067 |
| InChI Key: | XQMJXDMWUCTNID-UHFFFAOYSA-N |