2-{1-[2-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-[2-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
2-{1-[2-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | D750-0165 |
| Compound Name: | 2-{1-[2-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]cyclohexyl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C28 H31 N3 O3 |
| Smiles: | COc1ccc2c(c1)c1CN(CCc1[nH]2)C(CC1(CCCCC1)N1Cc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9116 |
| logD: | 3.9116 |
| logSw: | -4.1325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.396 |
| InChI Key: | UASXGCWCMCMSAE-UHFFFAOYSA-N |