2,3-dicyano-8,9,9-trimethyl-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxylic acid
Chemical Structure Depiction of
2,3-dicyano-8,9,9-trimethyl-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxylic acid
2,3-dicyano-8,9,9-trimethyl-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxylic acid
Compound characteristics
| Compound ID: | 8016-5444 |
| Compound Name: | 2,3-dicyano-8,9,9-trimethyl-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxylic acid |
| Molecular Weight: | 282.3 |
| Molecular Formula: | C15 H14 N4 O2 |
| Smiles: | CC12CCC(C(O)=O)(c3c1nc(C#N)c(C#N)n3)C2(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7445 |
| logD: | -1.0817 |
| logSw: | -1.4074 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.817 |
| InChI Key: | JXHJMPFFKUCDFI-UHFFFAOYSA-N |