N-[3-{1-[(2-methoxyethyl)amino]-1-oxopropan-2-yl}-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
Chemical Structure Depiction of
N-[3-{1-[(2-methoxyethyl)amino]-1-oxopropan-2-yl}-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
N-[3-{1-[(2-methoxyethyl)amino]-1-oxopropan-2-yl}-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide
Compound characteristics
| Compound ID: | V007-3136 |
| Compound Name: | N-[3-{1-[(2-methoxyethyl)amino]-1-oxopropan-2-yl}-1,3-benzothiazol-2(3H)-ylidene]-4-methylbenzamide |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | CC(C(NCCOC)=O)N1/C(=N/C(c2ccc(C)cc2)=O)Sc2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7909 |
| logD: | 2.7909 |
| logSw: | -3.2892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.74 |
| InChI Key: | UBQUOVDKKPXDDR-MBSKJGAKSA-N |