2-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Chemical Structure Depiction of
2-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
2-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Compound characteristics
| Compound ID: | 8013-7799 |
| Compound Name: | 2-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C20 H18 Cl N7 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(CSc1nnnn1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0396 |
| logD: | 2.0088 |
| logSw: | -2.8478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.419 |
| InChI Key: | GSDRDCBVLQWWIU-UHFFFAOYSA-N |