N-[1-(adamantan-1-yl)ethyl]-4-(2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-4-(2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[1-(adamantan-1-yl)ethyl]-4-(2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-1420 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-4-(2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C25 H34 N2 O3 |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CCC(N1CC(C)Oc2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1033 |
| logD: | 4.1033 |
| logSw: | -4.2569 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.74 |
| InChI Key: | RRBMJLMBKQNWRY-UHFFFAOYSA-N |