2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide
2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y500-4069 |
| Compound Name: | 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C16 H17 N5 O3 S |
| Smiles: | CC(Cn1c(C)cc(n1)[N+]([O-])=O)C(Nc1nc2ccc(C)cc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0381 |
| logD: | 3.0379 |
| logSw: | -3.2358 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.136 |
| InChI Key: | WYIUBICEHXPELQ-JTQLQIEISA-N |