5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide
5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0240 |
| Compound Name: | 5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 373.47 |
| Molecular Formula: | C19 H23 N3 O3 S |
| Smiles: | Cc1ccc(cc1C)c1cc(C(NCC=C)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1994 |
| logD: | 2.1994 |
| logSw: | -2.6832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.858 |
| InChI Key: | KRVBOHNWKHCIDD-MRXNPFEDSA-N |