ethyl {3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Chemical Structure Depiction of
ethyl {3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazol-1-yl}acetate
ethyl {3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Compound characteristics
| Compound ID: | 8018-0986 |
| Compound Name: | ethyl {3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1H-pyrazol-1-yl}acetate |
| Molecular Weight: | 363.82 |
| Molecular Formula: | C16 H14 Cl N3 O3 S |
| Smiles: | CCOC(Cn1ccc(NC(c2c(c3ccccc3s2)[Cl])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3312 |
| logD: | 3.2718 |
| logSw: | -3.9409 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.463 |
| InChI Key: | NXBOBXAFPLYBAJ-UHFFFAOYSA-N |