benzyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Chemical Structure Depiction of
benzyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
benzyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Compound characteristics
| Compound ID: | 5066-0232 |
| Compound Name: | benzyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C25 H21 N3 O4 |
| Smiles: | CC1=C(C(=O)OCc2ccccc2)C2(C(C#N)=C(N)O1)C(N(CC=C)c1ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3545 |
| logD: | 3.3545 |
| logSw: | -3.9994 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.269 |
| InChI Key: | MQYPUUDNNFCSCA-RUZDIDTESA-N |