6-{methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
6-{methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y508-8585 |
| Compound Name: | 6-{methyl[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 305.38 |
| Molecular Formula: | C16 H23 N3 O3 |
| Smiles: | Cc1c(CN(C)C(C2CC=CCC2C(O)=O)=O)c(C)n(C)n1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.6202 |
| logD: | -1.7356 |
| logSw: | -1.217 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.829 |
| InChI Key: | CRHBLLDNNBKIOW-UHFFFAOYSA-N |