N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
Compound characteristics
| Compound ID: | Y042-6571 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-2-[(6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide |
| Molecular Weight: | 411.84 |
| Molecular Formula: | C21 H18 Cl N3 O4 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])OCC(N[C@@H](C)c1nc2ccccc2[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3889 |
| logD: | 3.3867 |
| logSw: | -3.9385 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.886 |
| InChI Key: | KERCVHZNWJZBET-LBPRGKRZSA-N |