N-[(1-ethylpyrrolidin-2-yl)methyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | C307-0030 |
| Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C30 H30 F N3 O3 |
| Smiles: | CCN1CCCC1CNC(c1ccc(/C=C2/C(N(Cc3ccccc3F)c3ccccc3O2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6472 |
| logD: | 4.1068 |
| logSw: | -4.3281 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.353 |
| InChI Key: | KSUJCBMNXBAIDV-XMMPIXPASA-N |