1-(2-chloro-5-nitrophenyl)-2-[(2-methoxy-5-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
1-(2-chloro-5-nitrophenyl)-2-[(2-methoxy-5-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
1-(2-chloro-5-nitrophenyl)-2-[(2-methoxy-5-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V023-2285 |
| Compound Name: | 1-(2-chloro-5-nitrophenyl)-2-[(2-methoxy-5-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 456.88 |
| Molecular Formula: | C22 H21 Cl N4 O5 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1CN1CCCn2cccc2C1c1cc(ccc1[Cl])[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0282 |
| logD: | 5.0281 |
| logSw: | -5.3237 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.335 |
| InChI Key: | ALCJNAVBAWGNRN-JOCHJYFZSA-N |