N-(2-methoxyethyl)-1-{[(2S)-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-1-{[(2S)-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-(2-methoxyethyl)-1-{[(2S)-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1367 |
| Compound Name: | N-(2-methoxyethyl)-1-{[(2S)-1-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C21 H29 N5 O4 S |
| Smiles: | COCCNC(c1cn(C[C@@H]2CCCN2S(c2ccc3CCCCc3c2)(=O)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1769 |
| logD: | 2.1769 |
| logSw: | -2.7508 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.041 |
| InChI Key: | FCXRUKIDCDPAGL-SFHVURJKSA-N |