N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-5-methylpyrazine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-5-methylpyrazine-2-carboxamide
N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-5-methylpyrazine-2-carboxamide
Compound characteristics
| Compound ID: | T987-2428 |
| Compound Name: | N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-5-methylpyrazine-2-carboxamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C21 H26 N4 O3 |
| Smiles: | CCOc1cccc(CNC([C@H]2CCC[C@H]2NC(c2cnc(C)cn2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6075 |
| logD: | 1.6075 |
| logSw: | -2.3934 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.751 |
| InChI Key: | JCCUQELZILDOGO-MSOLQXFVSA-N |