3-(2-chlorophenyl)-N,N-bis(cyanomethyl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N,N-bis(cyanomethyl)-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-N,N-bis(cyanomethyl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | 1778-2739 |
| Compound Name: | 3-(2-chlorophenyl)-N,N-bis(cyanomethyl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 314.73 |
| Molecular Formula: | C15 H11 Cl N4 O2 |
| Smiles: | Cc1c(C(N(CC#N)CC#N)=O)c(c2ccccc2[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 1.3974 |
| logD: | 1.3974 |
| logSw: | -2.9636 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 73.622 |
| InChI Key: | KXFCOTSWDOZFQM-UHFFFAOYSA-N |