N-(2-bromo-4-methylphenyl)-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)methioninamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)methioninamide
N-(2-bromo-4-methylphenyl)-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)methioninamide
Compound characteristics
| Compound ID: | K906-1848 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)methioninamide |
| Molecular Weight: | 528.44 |
| Molecular Formula: | C20 H22 Br N3 O5 S2 |
| Smiles: | Cc1ccc(c(c1)[Br])NC(C(CCSC)NS(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7273 |
| logD: | 3.7269 |
| logSw: | -4.0968 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.371 |
| InChI Key: | BWJGXITWYNPVJD-INIZCTEOSA-N |