7-bromo-5-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]pyrrolo[1,2-a]quinoxalin-4(5H)-one
Chemical Structure Depiction of
7-bromo-5-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]pyrrolo[1,2-a]quinoxalin-4(5H)-one
7-bromo-5-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]pyrrolo[1,2-a]quinoxalin-4(5H)-one
Compound characteristics
| Compound ID: | E228-3042 |
| Compound Name: | 7-bromo-5-[4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-oxobutyl]pyrrolo[1,2-a]quinoxalin-4(5H)-one |
| Molecular Weight: | 474.35 |
| Molecular Formula: | C22 H24 Br N3 O4 |
| Smiles: | C(CC(N1CCC2(CC1)OCCO2)=O)CN1C(c2cccn2c2ccc(cc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4681 |
| logD: | 2.4681 |
| logSw: | -2.6662 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.773 |
| InChI Key: | MLJXYAXOJKROKK-UHFFFAOYSA-N |