N-[2-(3-bromophenyl)-8-methoxy-5-oxo-5H-[1]benzopyrano[4,3-d]pyrimidin-4-yl]acetamide
Chemical Structure Depiction of
N-[2-(3-bromophenyl)-8-methoxy-5-oxo-5H-[1]benzopyrano[4,3-d]pyrimidin-4-yl]acetamide
N-[2-(3-bromophenyl)-8-methoxy-5-oxo-5H-[1]benzopyrano[4,3-d]pyrimidin-4-yl]acetamide
Compound characteristics
Compound ID: | 8017-9787 |
Compound Name: | N-[2-(3-bromophenyl)-8-methoxy-5-oxo-5H-[1]benzopyrano[4,3-d]pyrimidin-4-yl]acetamide |
Molecular Weight: | 440.25 |
Molecular Formula: | C20 H14 Br N3 O4 |
Smiles: | CC(Nc1c2C(=O)Oc3cc(ccc3c2nc(c2cccc(c2)[Br])n1)OC)=O |
Stereo: | ACHIRAL |
logP: | 4.3476 |
logD: | 4.3353 |
logSw: | -4.6594 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.495 |
InChI Key: | RKPCXEZYRXHBNB-UHFFFAOYSA-N |