5-({6-[(4-chlorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}methyl)-N-(3-methylbutyl)furan-2-carboxamide
Chemical Structure Depiction of
5-({6-[(4-chlorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}methyl)-N-(3-methylbutyl)furan-2-carboxamide
5-({6-[(4-chlorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}methyl)-N-(3-methylbutyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V022-4353 |
| Compound Name: | 5-({6-[(4-chlorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}methyl)-N-(3-methylbutyl)furan-2-carboxamide |
| Molecular Weight: | 510.97 |
| Molecular Formula: | C27 H27 Cl N2 O6 |
| Smiles: | CC(C)CCNC(c1ccc(CN2C(COc3ccc(cc23)C(COc2ccc(cc2)[Cl])=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5352 |
| logD: | 4.5352 |
| logSw: | -4.7036 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.91 |
| InChI Key: | JQCGRMYXNJUPFW-UHFFFAOYSA-N |