4-[(6-chloro-4-ethyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-N,N-dimethylpiperazine-1-sulfonamide
Chemical Structure Depiction of
4-[(6-chloro-4-ethyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-N,N-dimethylpiperazine-1-sulfonamide
4-[(6-chloro-4-ethyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-N,N-dimethylpiperazine-1-sulfonamide
Compound characteristics
| Compound ID: | Y043-3810 |
| Compound Name: | 4-[(6-chloro-4-ethyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-N,N-dimethylpiperazine-1-sulfonamide |
| Molecular Weight: | 429.92 |
| Molecular Formula: | C18 H24 Cl N3 O5 S |
| Smiles: | CCC1=CC(=O)Oc2c1cc(c(c2CN1CCN(CC1)S(N(C)C)(=O)=O)O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.3643 |
| logD: | 2.2904 |
| logSw: | -3.3652 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.419 |
| InChI Key: | DTVXYBLQZMCNOE-UHFFFAOYSA-N |