N-[1-butyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[1-butyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]thiophene-2-carboxamide
N-[1-butyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8019-1665 |
| Compound Name: | N-[1-butyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]thiophene-2-carboxamide |
| Molecular Weight: | 416.38 |
| Molecular Formula: | C16 H15 F3 N4 O4 S |
| Smiles: | CCCCN1C2=C(C(NC1=O)=O)C(C(N2)=O)(C(F)(F)F)NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2581 |
| logD: | -0.3513 |
| logSw: | -2.9169 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.482 |
| InChI Key: | HQOUONMRVUXGHR-HNNXBMFYSA-N |