2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 8015-6748 |
| Compound Name: | 2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C15 H17 N5 O4 S |
| Smiles: | CC(C(Nc1c(C(N)=O)c2CCCCc2s1)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5172 |
| logD: | 0.0074 |
| logSw: | -1.9818 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.066 |
| InChI Key: | RCQQPRORVSFHFR-QMMMGPOBSA-N |