5'-acetyl-2'-amino-6'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carbonitrile
Chemical Structure Depiction of
5'-acetyl-2'-amino-6'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carbonitrile
5'-acetyl-2'-amino-6'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carbonitrile
Compound characteristics
| Compound ID: | 8006-4461 |
| Compound Name: | 5'-acetyl-2'-amino-6'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carbonitrile |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C16 H12 N4 O5 |
| Smiles: | CC1=C(C(C)=O)C2(C(C#N)=C(N)O1)C(Nc1ccc(cc12)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8895 |
| logD: | 0.861 |
| logSw: | -2.3993 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 119.144 |
| InChI Key: | WKQXQIHKGALUHT-MRXNPFEDSA-N |