N-[3-(1-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-oxopropan-2-yl)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
Chemical Structure Depiction of
N-[3-(1-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-oxopropan-2-yl)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
N-[3-(1-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-oxopropan-2-yl)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
Compound characteristics
| Compound ID: | V026-2900 |
| Compound Name: | N-[3-(1-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-oxopropan-2-yl)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide |
| Molecular Weight: | 531.67 |
| Molecular Formula: | C30 H33 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C(N(C)CCc1ccc(c(c1)OC)OC)=O)N1/C(=N/C(c2ccc(C)cc2)=O)Sc2cc(C)ccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8106 |
| logD: | 4.8106 |
| logSw: | -4.5779 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.261 |
| InChI Key: | WMWKQSAKYFPKAC-NRFANRHFSA-N |