N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[(5-methylfuran-2-yl)methyl]-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[(5-methylfuran-2-yl)methyl]-6-oxopiperazine-2-carboxamide
N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[(5-methylfuran-2-yl)methyl]-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-2871 |
| Compound Name: | N-benzyl-2-methyl-4-(4-methylbenzene-1-sulfonyl)-1-[(5-methylfuran-2-yl)methyl]-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C26 H29 N3 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(N(Cc2ccc(C)o2)C(C)(C1)C(NCc1ccccc1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.568 |
| logD: | 3.5678 |
| logSw: | -3.7669 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.544 |
| InChI Key: | XFOCBUWCQJOAPJ-SANMLTNESA-N |