ethyl 4-(2-{4-[(4-bromothiophene-2-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}propanoyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-{4-[(4-bromothiophene-2-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}propanoyl)piperazine-1-carboxylate
ethyl 4-(2-{4-[(4-bromothiophene-2-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}propanoyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | Y503-3345 |
| Compound Name: | ethyl 4-(2-{4-[(4-bromothiophene-2-carbonyl)amino]-3-methyl-1H-pyrazol-1-yl}propanoyl)piperazine-1-carboxylate |
| Molecular Weight: | 498.4 |
| Molecular Formula: | C19 H24 Br N5 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(C(C)n1cc(c(C)n1)NC(c1cc(cs1)[Br])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2616 |
| logD: | 2.2214 |
| logSw: | -2.8963 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.013 |
| InChI Key: | KQZITDDJKQODCO-ZDUSSCGKSA-N |