N-butyl-4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-methylbenzamide
Chemical Structure Depiction of
N-butyl-4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-methylbenzamide
N-butyl-4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-methylbenzamide
Compound characteristics
| Compound ID: | K788-6800 |
| Compound Name: | N-butyl-4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-methylbenzamide |
| Molecular Weight: | 474.99 |
| Molecular Formula: | C28 H27 Cl N2 O3 |
| Smiles: | CCCCN(C)C(c1ccc(/C=C2/C(N(Cc3ccc(cc3)[Cl])c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6639 |
| logD: | 5.6639 |
| logSw: | -5.9948 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.433 |
| InChI Key: | SWJVPLMEYDSYAR-UHFFFAOYSA-N |