N-[2-(3,4-diethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1122 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C25 H32 N2 O5 |
| Smiles: | CCOc1ccc(CCNC(CCC(N2CCOc3ccc(C)cc23)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.3352 |
| logD: | 2.3352 |
| logSw: | -2.7605 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.709 |
| InChI Key: | IHLGOZOUAIPLQL-UHFFFAOYSA-N |