methyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Chemical Structure Depiction of
methyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
methyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Compound characteristics
| Compound ID: | 8017-8700 |
| Compound Name: | methyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C21 H17 N3 O4 S |
| Smiles: | Cc1c(C(=O)OC)c2c(C3(C(C#N)=C(N)O2)C(N(CC=C)c2ccccc23)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9657 |
| logD: | 2.9657 |
| logSw: | -3.5528 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.889 |
| InChI Key: | OQHHJAQPCNGCQP-NRFANRHFSA-N |