N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Compound characteristics
| Compound ID: | E005-0301 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide |
| Molecular Weight: | 455.31 |
| Molecular Formula: | C21 H19 Br N4 O3 |
| Smiles: | CC1=CC(N=C2c3ccccc3N(CC(NCc3cc(ccc3OC)[Br])=O)N12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7013 |
| logD: | 2.7013 |
| logSw: | -3.4613 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.74 |
| InChI Key: | FYJCCLUVUNWCOK-UHFFFAOYSA-N |