ethyl 4-{5-[(morpholin-4-yl)(3-nitrophenyl)methyl]-1H-tetrazol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{5-[(morpholin-4-yl)(3-nitrophenyl)methyl]-1H-tetrazol-1-yl}benzoate
ethyl 4-{5-[(morpholin-4-yl)(3-nitrophenyl)methyl]-1H-tetrazol-1-yl}benzoate
Compound characteristics
| Compound ID: | 8013-8000 |
| Compound Name: | ethyl 4-{5-[(morpholin-4-yl)(3-nitrophenyl)methyl]-1H-tetrazol-1-yl}benzoate |
| Molecular Weight: | 438.44 |
| Molecular Formula: | C21 H22 N6 O5 |
| Smiles: | CCOC(c1ccc(cc1)n1c(C(c2cccc(c2)[N+]([O-])=O)N2CCOCC2)nnn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1219 |
| logD: | 3.1219 |
| logSw: | -3.24 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 104.376 |
| InChI Key: | UKSLTJRBOWWSJF-LJQANCHMSA-N |