5-({3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-({3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
5-({3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6049 |
| Compound Name: | 5-({3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}carbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)Oc2ccccc2)n1)NC(c1c(cnn1C)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6639 |
| logD: | -1.5249 |
| logSw: | -3.152 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.887 |
| InChI Key: | PREDJWIAEKWFRX-UHFFFAOYSA-N |