2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-(thiomorpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-(thiomorpholine-4-sulfonyl)benzamide
2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-(thiomorpholine-4-sulfonyl)benzamide
Compound characteristics
| Compound ID: | L586-1463 |
| Compound Name: | 2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-(thiomorpholine-4-sulfonyl)benzamide |
| Molecular Weight: | 471.04 |
| Molecular Formula: | C20 H27 Cl N4 O3 S2 |
| Smiles: | CCn1c(C)c(CCNC(c2cc(ccc2[Cl])S(N2CCSCC2)(=O)=O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5592 |
| logD: | 2.5585 |
| logSw: | -3.7071 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.482 |
| InChI Key: | VBAZSXIZJHEMGT-UHFFFAOYSA-N |