N-[(5-methylfuran-2-yl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-4-carboxamide
N-[(5-methylfuran-2-yl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F855-0208 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-1-(1-propyl-1H-benzotriazole-5-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C21 H27 N5 O4 S |
| Smiles: | CCCn1c2ccc(cc2nn1)S(N1CCC(CC1)C(NCc1ccc(C)o1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4194 |
| logD: | 2.4194 |
| logSw: | -2.7821 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.302 |
| InChI Key: | YJEGGTWYWCALNH-UHFFFAOYSA-N |