ethyl 4-[(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)(3-methoxypropyl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)(3-methoxypropyl)carbamamido]benzoate
ethyl 4-[(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)(3-methoxypropyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | V004-9093 |
| Compound Name: | ethyl 4-[(2-{[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)(3-methoxypropyl)carbamamido]benzoate |
| Molecular Weight: | 563.7 |
| Molecular Formula: | C31 H41 N5 O5 |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CCCOC)CC(Nc1cc(C(C)(C)C)nn1c1ccc(C)cc1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5184 |
| logD: | 6.5182 |
| logSw: | -5.4975 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.628 |
| InChI Key: | YHSLWYRAKJPMTI-UHFFFAOYSA-N |