4-amino-N-[2-(3-chloro-2-methyl-4,6-dinitroanilino)ethyl]-1,2,5-oxadiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-[2-(3-chloro-2-methyl-4,6-dinitroanilino)ethyl]-1,2,5-oxadiazole-3-carboxamide
4-amino-N-[2-(3-chloro-2-methyl-4,6-dinitroanilino)ethyl]-1,2,5-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | 8010-6612 |
| Compound Name: | 4-amino-N-[2-(3-chloro-2-methyl-4,6-dinitroanilino)ethyl]-1,2,5-oxadiazole-3-carboxamide |
| Molecular Weight: | 385.72 |
| Molecular Formula: | C12 H12 Cl N7 O6 |
| Smiles: | Cc1c(c(cc(c1[Cl])[N+]([O-])=O)[N+]([O-])=O)NCCNC(c1c(N)non1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2058 |
| logD: | 1.2058 |
| logSw: | -2.8849 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 156.691 |
| InChI Key: | GDWSWJBMLYFMPQ-UHFFFAOYSA-N |