methyl 2-[(4-bromo-1-methyl-1H-pyrazole-3-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(4-bromo-1-methyl-1H-pyrazole-3-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
methyl 2-[(4-bromo-1-methyl-1H-pyrazole-3-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-9480 |
| Compound Name: | methyl 2-[(4-bromo-1-methyl-1H-pyrazole-3-carbonyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 457.34 |
| Molecular Formula: | C17 H21 Br N4 O4 S |
| Smiles: | CCN(CC)C(c1c(C)c(C(=O)OC)c(NC(c2c(cn(C)n2)[Br])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0016 |
| logD: | -1.1707 |
| logSw: | -2.6135 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.586 |
| InChI Key: | YQLSZLPCBQITDY-UHFFFAOYSA-N |