4-[(4-ethylpiperazin-1-yl)acetyl]-9-(pentyloxy)-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Chemical Structure Depiction of
4-[(4-ethylpiperazin-1-yl)acetyl]-9-(pentyloxy)-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
4-[(4-ethylpiperazin-1-yl)acetyl]-9-(pentyloxy)-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Compound characteristics
Compound ID: | C285-0117 |
Compound Name: | 4-[(4-ethylpiperazin-1-yl)acetyl]-9-(pentyloxy)-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one |
Molecular Weight: | 441.57 |
Molecular Formula: | C25 H35 N3 O4 |
Smiles: | CCCCCOc1ccc2c(c1)C1CCCN(C=1C(=O)O2)C(CN1CCN(CC)CC1)=O |
Stereo: | ACHIRAL |
logP: | 3.4582 |
logD: | 2.6642 |
logSw: | -3.5975 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 51.138 |
InChI Key: | GFGMBECSSJFZOC-UHFFFAOYSA-N |