N-[6-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
Chemical Structure Depiction of
N-[6-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
N-[6-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | F222-0826 |
| Compound Name: | N-[6-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3-benzothiazol-2-yl]butanamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C23 H27 N3 O3 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(NCc3ccc(cc3)OCC)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3692 |
| logD: | 4.3691 |
| logSw: | -4.2653 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.473 |
| InChI Key: | VPLLOHAQAJVTCO-UHFFFAOYSA-N |