methyl N-{[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}alaninate
Chemical Structure Depiction of
methyl N-{[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}alaninate
methyl N-{[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}alaninate
Compound characteristics
| Compound ID: | G531-0075 |
| Compound Name: | methyl N-{[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}alaninate |
| Molecular Weight: | 282.34 |
| Molecular Formula: | C13 H22 N4 O3 |
| Smiles: | CC(C(=O)OC)NC(NCCc1c(C)nn(C)c1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1498 |
| logD: | -0.1502 |
| logSw: | -0.7295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.475 |
| InChI Key: | VVBMTHXSRWMSBO-VIFPVBQESA-N |