4-[1-(3-methoxypropyl)-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl]benzoic acid
Chemical Structure Depiction of
4-[1-(3-methoxypropyl)-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl]benzoic acid
4-[1-(3-methoxypropyl)-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl]benzoic acid
Compound characteristics
| Compound ID: | 6484-0099 |
| Compound Name: | 4-[1-(3-methoxypropyl)-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl]benzoic acid |
| Molecular Weight: | 459.46 |
| Molecular Formula: | C25 H21 N3 O6 |
| Smiles: | COCCCN1C2=C(C(C3=C(c4ccccc4C3=O)N2)c2ccc(cc2)C(O)=O)C(NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6542 |
| logD: | -0.3173 |
| logSw: | -3.3242 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.388 |
| InChI Key: | DXWWYCHXVXOBGX-KRWDZBQOSA-N |