4-(4-{[N-benzyl-N-(4-chlorobenzene-1-sulfonyl)glycyl]amino}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-benzyl-N-(4-chlorobenzene-1-sulfonyl)glycyl]amino}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide
4-(4-{[N-benzyl-N-(4-chlorobenzene-1-sulfonyl)glycyl]amino}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V025-4063 |
| Compound Name: | 4-(4-{[N-benzyl-N-(4-chlorobenzene-1-sulfonyl)glycyl]amino}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 584.14 |
| Molecular Formula: | C29 H34 Cl N5 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(N1CCN(CC1)c1ccc(cc1)NC(CN(Cc1ccccc1)S(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0312 |
| logD: | 5.0088 |
| logSw: | -5.0699 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.789 |
| InChI Key: | CTXMYBWZROYSHA-UHFFFAOYSA-N |