ethyl 1-{[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetyl}piperidine-3-carboxylate
ethyl 1-{[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | L880-0057 |
| Compound Name: | ethyl 1-{[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetyl}piperidine-3-carboxylate |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C24 H30 N4 O5 S |
| Smiles: | CCN1C(=Nc2c3cc(ccc3n(C)c2C1=O)OC)SCC(N1CCCC(C1)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7641 |
| logD: | 2.7641 |
| logSw: | -3.103 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.062 |
| InChI Key: | JCTLCHWVLJTJBI-HNNXBMFYSA-N |