3-({[1'-(cyclobutanecarbonyl)-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
Chemical Structure Depiction of
3-({[1'-(cyclobutanecarbonyl)-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
3-({[1'-(cyclobutanecarbonyl)-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid
Compound characteristics
| Compound ID: | SA91-0160 |
| Compound Name: | 3-({[1'-(cyclobutanecarbonyl)-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidine]-5-carbonyl]amino}methyl)benzoic acid |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C27 H29 N3 O5 |
| Smiles: | CN1C(C2(CCN(CC2)C(C2CCC2)=O)c2cc(ccc12)C(NCc1cccc(c1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0242 |
| logD: | -1.3372 |
| logSw: | -2.5848 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.466 |
| InChI Key: | CUOCVCCUCRQRLE-UHFFFAOYSA-N |