N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(3-methylphenyl)methioninamide
Chemical Structure Depiction of
N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(3-methylphenyl)methioninamide
N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(3-methylphenyl)methioninamide
Compound characteristics
| Compound ID: | K906-1855 |
| Compound Name: | N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(3-methylphenyl)methioninamide |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C20 H23 N3 O5 S2 |
| Smiles: | Cc1cccc(c1)NC(C(CCSC)NS(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0072 |
| logD: | 3.007 |
| logSw: | -3.5358 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.069 |
| InChI Key: | ZKNOMPBVDZBUMN-INIZCTEOSA-N |