ethyl 4-methyl-2-{[N-(4-phenylpiperazine-1-carbonyl)-L-alanyl]amino}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-methyl-2-{[N-(4-phenylpiperazine-1-carbonyl)-L-alanyl]amino}-1,3-thiazole-5-carboxylate
ethyl 4-methyl-2-{[N-(4-phenylpiperazine-1-carbonyl)-L-alanyl]amino}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y043-7794 |
| Compound Name: | ethyl 4-methyl-2-{[N-(4-phenylpiperazine-1-carbonyl)-L-alanyl]amino}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C21 H27 N5 O4 S |
| Smiles: | CCOC(c1c(C)nc(NC([C@H](C)NC(N2CCN(CC2)c2ccccc2)=O)=O)s1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.2631 |
| logD: | 3.2178 |
| logSw: | -3.3549 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.193 |
| InChI Key: | ZMLOXRYULGWWRN-HNNXBMFYSA-N |