ethyl 2-{[1-(5-nitro-2H-tetrazol-2-yl)propan-2-ylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[1-(5-nitro-2H-tetrazol-2-yl)propan-2-ylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-{[1-(5-nitro-2H-tetrazol-2-yl)propan-2-ylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8007-8747 |
| Compound Name: | ethyl 2-{[1-(5-nitro-2H-tetrazol-2-yl)propan-2-ylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 364.38 |
| Molecular Formula: | C14 H16 N6 O4 S |
| Smiles: | CCOC(c1c2CCCc2sc1/N=C(\C)Cn1nc(nn1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2306 |
| logD: | 2.2306 |
| logSw: | -2.0308 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 99.565 |
| InChI Key: | DJCOTHLUUCBEOZ-UHFFFAOYSA-N |