methyl 2-amino-5'-bromo-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-5'-bromo-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
methyl 2-amino-5'-bromo-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Compound characteristics
| Compound ID: | 8005-2606 |
| Compound Name: | methyl 2-amino-5'-bromo-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate |
| Molecular Weight: | 419.23 |
| Molecular Formula: | C18 H15 Br N2 O5 |
| Smiles: | COC(C1=C(N)OC2CCCC(C=2C12C(Nc1ccc(cc12)[Br])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1611 |
| logD: | 2.1593 |
| logSw: | -3.0934 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.963 |
| InChI Key: | ARTYSPAGNBRVCS-GOSISDBHSA-N |