tert-butyl 4-[4-({3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}carbamoyl)-1-methyl-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[4-({3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}carbamoyl)-1-methyl-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[4-({3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}carbamoyl)-1-methyl-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E951-1240 |
| Compound Name: | tert-butyl 4-[4-({3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}carbamoyl)-1-methyl-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 538.73 |
| Molecular Formula: | C30 H46 N6 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CCCNC(c2cnn(C)c2C2CCN(CC2)C(=O)OC(C)(C)C)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.1339 |
| logD: | 3.9873 |
| logSw: | -4.7507 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.761 |
| InChI Key: | VUVFSHXGJPKDST-UHFFFAOYSA-N |