ethyl 2-[4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-[4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | C163-0171 |
| Compound Name: | ethyl 2-[4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C18 H22 N4 O5 S |
| Smiles: | CCOC(c1c2CCCc2sc1NC(CCCn1c(C)cc(n1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8529 |
| logD: | -0.9652 |
| logSw: | -2.6501 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.975 |
| InChI Key: | AHMNIVGKXJOPJO-UHFFFAOYSA-N |