4-(4-{[N-benzyl-N-(4-methylbenzene-1-sulfonyl)glycyl]amino}phenyl)-N-tert-butylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-benzyl-N-(4-methylbenzene-1-sulfonyl)glycyl]amino}phenyl)-N-tert-butylpiperazine-1-carboxamide
4-(4-{[N-benzyl-N-(4-methylbenzene-1-sulfonyl)glycyl]amino}phenyl)-N-tert-butylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V024-7078 |
| Compound Name: | 4-(4-{[N-benzyl-N-(4-methylbenzene-1-sulfonyl)glycyl]amino}phenyl)-N-tert-butylpiperazine-1-carboxamide |
| Molecular Weight: | 577.75 |
| Molecular Formula: | C31 H39 N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N(CC(Nc1ccc(cc1)N1CCN(CC1)C(NC(C)(C)C)=O)=O)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3077 |
| logD: | 5.2853 |
| logSw: | -5.1847 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.639 |
| InChI Key: | YMSYMGXIURLURG-UHFFFAOYSA-N |