3-[(2H-1,3-benzodioxole-5-carbonyl)amino]-N-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyrazine-2-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxole-5-carbonyl)amino]-N-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyrazine-2-carboxamide
3-[(2H-1,3-benzodioxole-5-carbonyl)amino]-N-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | V014-3533 |
| Compound Name: | 3-[(2H-1,3-benzodioxole-5-carbonyl)amino]-N-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyrazine-2-carboxamide |
| Molecular Weight: | 541.49 |
| Molecular Formula: | C26 H22 F3 N5 O5 |
| Salt: | not_available |
| Smiles: | C1CN(CCC1NC(c1c(NC(c2ccc3c(c2)OCO3)=O)nccn1)=O)C(c1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3708 |
| logD: | 2.0837 |
| logSw: | -3.1129 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.546 |
| InChI Key: | RWRSWXBZMNGCBD-UHFFFAOYSA-N |