propan-2-yl 2-[(4-bromo-1,5-dimethyl-1H-pyrazole-3-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-[(4-bromo-1,5-dimethyl-1H-pyrazole-3-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
propan-2-yl 2-[(4-bromo-1,5-dimethyl-1H-pyrazole-3-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-4653 |
| Compound Name: | propan-2-yl 2-[(4-bromo-1,5-dimethyl-1H-pyrazole-3-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 471.37 |
| Molecular Formula: | C18 H23 Br N4 O4 S |
| Smiles: | CC(C)OC(c1c(C)c(C(N(C)C)=O)sc1NC(c1c(c(C)n(C)n1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0564 |
| logD: | -0.9342 |
| logSw: | -2.6421 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.59 |
| InChI Key: | KIHJQKSOQXPAGV-UHFFFAOYSA-N |