4-(methoxymethyl)-2,6-dimethyl-9,10-dinitropyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole
Chemical Structure Depiction of
4-(methoxymethyl)-2,6-dimethyl-9,10-dinitropyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole
4-(methoxymethyl)-2,6-dimethyl-9,10-dinitropyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole
Compound characteristics
| Compound ID: | 8012-6734 |
| Compound Name: | 4-(methoxymethyl)-2,6-dimethyl-9,10-dinitropyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole |
| Molecular Weight: | 438.42 |
| Molecular Formula: | C19 H14 N6 O5 S |
| Smiles: | Cc1cc(COC)c2c3c(c4nc5cc(c(cc5n4c(C)n3)[N+]([O-])=O)[N+]([O-])=O)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.576 |
| logD: | 3.4594 |
| logSw: | -4.12 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 102.167 |
| InChI Key: | DMGHITIQPGWTCM-UHFFFAOYSA-N |