4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-(3-methoxypropyl)benzamide
Chemical Structure Depiction of
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-(3-methoxypropyl)benzamide
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-(3-methoxypropyl)benzamide
Compound characteristics
| Compound ID: | K788-6927 |
| Compound Name: | 4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-(3-methoxypropyl)benzamide |
| Molecular Weight: | 476.96 |
| Molecular Formula: | C27 H25 Cl N2 O4 |
| Smiles: | COCCCNC(c1ccc(\C=C2/C(N(Cc3ccc(cc3)[Cl])c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7985 |
| logD: | 4.7985 |
| logSw: | -5.2011 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.902 |
| InChI Key: | VWDYWBQFGSLNMQ-UHFFFAOYSA-N |