6-bromo-2-(3-methoxy-4-propoxyphenyl)-3-nitro-2H-1-benzopyran
Chemical Structure Depiction of
6-bromo-2-(3-methoxy-4-propoxyphenyl)-3-nitro-2H-1-benzopyran
6-bromo-2-(3-methoxy-4-propoxyphenyl)-3-nitro-2H-1-benzopyran
Compound characteristics
| Compound ID: | 6268-0992 |
| Compound Name: | 6-bromo-2-(3-methoxy-4-propoxyphenyl)-3-nitro-2H-1-benzopyran |
| Molecular Weight: | 420.26 |
| Molecular Formula: | C19 H18 Br N O5 |
| Smiles: | CCCOc1ccc(cc1OC)C1C(=Cc2cc(ccc2O1)[Br])[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3309 |
| logD: | 5.3309 |
| logSw: | -5.5057 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.813 |
| InChI Key: | KMGSKGITAQQSSQ-LJQANCHMSA-N |