methyl 4-{[N-benzyl-N-(4-fluorobenzene-1-sulfonyl)glycyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[N-benzyl-N-(4-fluorobenzene-1-sulfonyl)glycyl]amino}benzoate
methyl 4-{[N-benzyl-N-(4-fluorobenzene-1-sulfonyl)glycyl]amino}benzoate
Compound characteristics
| Compound ID: | 4413-0030 |
| Compound Name: | methyl 4-{[N-benzyl-N-(4-fluorobenzene-1-sulfonyl)glycyl]amino}benzoate |
| Molecular Weight: | 456.49 |
| Molecular Formula: | C23 H21 F N2 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(CN(Cc1ccccc1)S(c1ccc(cc1)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3086 |
| logD: | 4.3015 |
| logSw: | -4.3274 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.665 |
| InChI Key: | PFHBMHSYHQWGDH-UHFFFAOYSA-N |