N-benzyl-4-(4-cyano-5-{[2-(dimethylamino)ethyl]amino}-1,3-oxazol-2-yl)-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-benzyl-4-(4-cyano-5-{[2-(dimethylamino)ethyl]amino}-1,3-oxazol-2-yl)-N-methylbenzene-1-sulfonamide
N-benzyl-4-(4-cyano-5-{[2-(dimethylamino)ethyl]amino}-1,3-oxazol-2-yl)-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D434-0997 |
| Compound Name: | N-benzyl-4-(4-cyano-5-{[2-(dimethylamino)ethyl]amino}-1,3-oxazol-2-yl)-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C22 H25 N5 O3 S |
| Smiles: | CN(C)CCNc1c(C#N)nc(c2ccc(cc2)S(N(C)Cc2ccccc2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7759 |
| logD: | 1.2782 |
| logSw: | -3.3422 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.821 |
| InChI Key: | OIXOBEYHEGEQFY-UHFFFAOYSA-N |