3-({[1-methyl-2-oxo-1'-(pyrimidin-2-yl)-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
Chemical Structure Depiction of
3-({[1-methyl-2-oxo-1'-(pyrimidin-2-yl)-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
3-({[1-methyl-2-oxo-1'-(pyrimidin-2-yl)-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
Compound characteristics
| Compound ID: | SA91-0196 |
| Compound Name: | 3-({[1-methyl-2-oxo-1'-(pyrimidin-2-yl)-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid |
| Molecular Weight: | 471.52 |
| Molecular Formula: | C26 H25 N5 O4 |
| Smiles: | CN1C(C2(CCN(CC2)c2ncccn2)c2cc(ccc12)C(NCc1cccc(c1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7177 |
| logD: | -0.6437 |
| logSw: | -3.1698 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.109 |
| InChI Key: | DWNZXNZFEHTNSP-UHFFFAOYSA-N |