[4-({[(4-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)benzamido]oxidanide
Chemical Structure Depiction of
[4-({[(4-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)benzamido]oxidanide
[4-({[(4-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)benzamido]oxidanide
Compound characteristics
| Compound ID: | K783-4058 |
| Compound Name: | [4-({[(4-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)benzamido]oxidanide |
| Molecular Weight: | 553.45 |
| Molecular Formula: | C25 H26 Br N2 O4 S |
| Salt: | Na+ |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N(Cc1ccc(cc1)C(N[O-])=O)Cc1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5087 |
| logD: | 5.5087 |
| logSw: | -5.3045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.267 |
| InChI Key: | PXFZTRLIVYYDSE-UHFFFAOYSA-N |