N-benzyl-4-{4-cyano-5-[(prop-2-en-1-yl)amino]-1,3-oxazol-2-yl}-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-benzyl-4-{4-cyano-5-[(prop-2-en-1-yl)amino]-1,3-oxazol-2-yl}-N-methylbenzene-1-sulfonamide
N-benzyl-4-{4-cyano-5-[(prop-2-en-1-yl)amino]-1,3-oxazol-2-yl}-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D434-1011 |
| Compound Name: | N-benzyl-4-{4-cyano-5-[(prop-2-en-1-yl)amino]-1,3-oxazol-2-yl}-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CN(Cc1ccccc1)S(c1ccc(cc1)c1nc(C#N)c(NCC=C)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3088 |
| logD: | 3.3088 |
| logSw: | -3.7188 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.955 |
| InChI Key: | CLKOQOXRVBXDKN-UHFFFAOYSA-N |