EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H22N4O2 |
| Net Charge | 0 |
| Average Mass | 398.466 |
| Monoisotopic Mass | 398.17428 |
| SMILES | COc1cccc2c(NCc3ccccc3)nc(N3CCOc4ccccc43)nc12 |
| InChI | InChI=1S/C24H22N4O2/c1-29-21-13-7-10-18-22(21)26-24(27-23(18)25-16-17-8-3-2-4-9-17)28-14-15-30-20-12-6-5-11-19(20)28/h2-13H,14-16H2,1H3,(H,25,26,27) |
| InChIKey | IYXHYFRAECMMNU-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(2,3-dihydro-1,4-benzoxazin-4-yl)-8-methoxy-N-(phenylmethyl)-4-quinazolinamine (CHEBI:92009) is a aromatic amine (CHEBI:33860) |
| 2-(2,3-dihydro-1,4-benzoxazin-4-yl)-8-methoxy-N-(phenylmethyl)-4-quinazolinamine (CHEBI:92009) is a tertiary amino compound (CHEBI:50996) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1980 | LINCS |