4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-cyclopentylbenzamide
Chemical Structure Depiction of
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-cyclopentylbenzamide
4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-cyclopentylbenzamide
Compound characteristics
| Compound ID: | K788-6804 |
| Compound Name: | 4-({4-[(4-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-cyclopentylbenzamide |
| Molecular Weight: | 472.97 |
| Molecular Formula: | C28 H25 Cl N2 O3 |
| Smiles: | C1CCC(C1)NC(c1ccc(/C=C2/C(N(Cc3ccc(cc3)[Cl])c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9836 |
| logD: | 5.9836 |
| logSw: | -6.3898 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.537 |
| InChI Key: | ZVQPNDYQRGYAEJ-UHFFFAOYSA-N |