6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-benzothiophene-2-carboxamide
6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y070-0483 |
| Compound Name: | 6-tert-butyl-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 453.99 |
| Molecular Formula: | C24 H24 Cl N3 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(c1c(c2ccc(cc2s1)C(C)(C)C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0218 |
| logD: | 4.1968 |
| logSw: | -5.3467 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.458 |
| InChI Key: | VUDFCNDXWHJABR-UHFFFAOYSA-N |