7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-{[(3-methylphenyl)methanesulfonyl]methyl}-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-{[(3-methylphenyl)methanesulfonyl]methyl}-3,4-dihydroquinoxalin-2(1H)-one
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-{[(3-methylphenyl)methanesulfonyl]methyl}-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | K784-7109 |
| Compound Name: | 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-{[(3-methylphenyl)methanesulfonyl]methyl}-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C25 H29 N3 O6 S |
| Smiles: | Cc1cccc(CS(CC2C(Nc3cc(ccc3N2)C(N2CCC3(CC2)OCCO3)=O)=O)(=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6229 |
| logD: | 1.6228 |
| logSw: | -2.4615 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.483 |
| InChI Key: | QFJINZFVHWRTIB-QFIPXVFZSA-N |