N-[(5-bromo-2-methoxyphenyl)methyl]-1,7,7-trimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-1,7,7-trimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-1,7,7-trimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | C795-0534 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-1,7,7-trimethyl-9-oxo-8,9-dihydro-7H-furo[3,2-f][1]benzopyran-2-carboxamide |
| Molecular Weight: | 472.33 |
| Molecular Formula: | C23 H22 Br N O5 |
| Smiles: | Cc1c2c3C(CC(C)(C)Oc3ccc2oc1C(NCc1cc(ccc1OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6659 |
| logD: | 4.6658 |
| logSw: | -5.0082 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.389 |
| InChI Key: | RMLPCJOHGPFXPV-UHFFFAOYSA-N |