1',3',3'-trimethyl-6-nitro-7-[(propan-2-yl)oxy]-1',3'-dihydrospiro[[1]benzopyran-2,2'-indole]
Chemical Structure Depiction of
1',3',3'-trimethyl-6-nitro-7-[(propan-2-yl)oxy]-1',3'-dihydrospiro[[1]benzopyran-2,2'-indole]
1',3',3'-trimethyl-6-nitro-7-[(propan-2-yl)oxy]-1',3'-dihydrospiro[[1]benzopyran-2,2'-indole]
Compound characteristics
| Compound ID: | 0388-0049 |
| Compound Name: | 1',3',3'-trimethyl-6-nitro-7-[(propan-2-yl)oxy]-1',3'-dihydrospiro[[1]benzopyran-2,2'-indole] |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C22 H24 N2 O4 |
| Smiles: | CC(C)Oc1cc2c(C=CC3(C(C)(C)c4ccccc4N3C)O2)cc1[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0276 |
| logD: | 5.0276 |
| logSw: | -4.7134 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.402 |
| InChI Key: | RQTFHPUKIUEOTO-JOCHJYFZSA-N |