2-methoxyethyl 2-amino-5'-bromo-7,7-dimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 2-amino-5'-bromo-7,7-dimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
2-methoxyethyl 2-amino-5'-bromo-7,7-dimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Compound characteristics
| Compound ID: | Y508-2103 |
| Compound Name: | 2-methoxyethyl 2-amino-5'-bromo-7,7-dimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate |
| Molecular Weight: | 491.34 |
| Molecular Formula: | C22 H23 Br N2 O6 |
| Smiles: | CC1(C)CC2=C(C(C1)=O)C1(C(=C(N)O2)C(=O)OCCOC)C(Nc2ccc(cc12)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4093 |
| logD: | 2.4075 |
| logSw: | -3.0991 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.18 |
| InChI Key: | OSOUIBNSKWDOAI-JOCHJYFZSA-N |